A0A087XWI1_POEFO Loading...

Synaptic Ras GTPase activating protein 1

AlphaFold DB , UniProt , Accession A0A087XWI1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,242 aa.

						>A0A087XWI1_POEFO|A0A087XWI1
MEVPPTAPLQPFRQSSFLSKRLKGSIKRAKSQPKLDRTSSFRQMILPRFRSADQDRTRLMQSFKESHSHESLLSPSSAAEALDLTLDEDAIIKPVHSSILGQEYCFEVTTASGTKCFACRSAAERDKWIENLQRAVKPNKDNSRRVDNVLKLWIIEARELPAKKRYYCELCLDDMLYARTTSKPRTDTVFWGEHFEFNNLPAVRNLRLHLYKETDKKRRKEKSTYLGLVSIPISSITGRQFVEQWYPVIQPSVLTKGAGVGGGKIINASLRLKSRFQTMNILPMELYKEFAEYVTNNYRTLCAVLEPVLSVKSKEEVACALVHILQSTGKAKDFLSDMAMCEVDRFIDREHLIFRENTLATKAIEEYLKLIGHKYLKDAIGEFIRALYESEENCEVDPMRIPPSVLPDHQANLRMCCELALCKIVNSHCVFPRELKEVFASWRVRCAERGREDIADRLISGSLFLRFLCPAIMSPSLFNLTQEYPDEQTSRTLTLIAKVVQNLANFSKFGSKEEYMCFMNEFLEMEWGSMQQFLYEISNLDSVSNAGGFEGYIDLGRELSILHSLLWEVMAQLSKDAIIKLGPLPRLLNDISMALRNPHLQRQPSHQADRVQDRQSDRLLSRPSFNRGISSEFQNLMMRDLNSSIDITRLPSPTSTGGVMPSRAQLSFQDRDHPHRASKDMFYVSRPPLARSSPAYCTSSSDITEPDAKASIAGMGSFGGLSSGGGGGLGSGLSSQLRAGGRLSAGSGGSSMSGGLRLSQLSQMGTTTDSLSQQQQHQAAAMRYPLSFQNPLFHLATADGPQQQLHHQHSRAQPPAPLLLAPDPEPSHQAYIPQFAHGGFSRSEDLSTLRTRDGHLGQPSIIHSHSYSDDYSRADYGRRQISMHMQDNLQQQHEMMGMASQTGTSHSSLATTPPSTVQPMRQSSVAPPPSQRVKSQTSHQLSVSAAAAPAASGKSRPQSGNLLQSPESGYGGRQHGSRQLSVKDNTAPGLPHQQSSVRESGSPQGTTSQSTQQSPQQSQQHLLKPTMSKQGSQSPTTLNPPTPANERTVAWVSNMPHLSADIESSRIDREDFKLKEYSKSMDESRMDRVKEYEEEINSLKERLLMSHRKLEEYERRLLMQEQQTNKILLQYQNRLEDSERRLRQQQVEKDSQIKGIINRLMAVEDEIRGGAIYEPKTRIFADQGRRQSILVQPRLAPVPPRVPSHSQSFMEDNVEPNWLMHHRQSSGWHGQMSRALSRDAIG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	38.8	Very low	223 Å²	223	135.6 Å²	135.6	100%	1.099	78%	0.783	S	S	*	*				0	96.6	0	-65.3	171.1	177	0	0	110.5
2	E	31.7	Very low	37.6	Very low	158 Å²	158	137.1 Å²	137.1	74%	0.738	77%	0.774	S	S	*	*			cis	-164.5	123.3	-31.7	-109	146.6	134.9	0	0	105.7
3	V	31.3	Very low	36.8	Very low	132 Å²	132	141.7 Å²	141.7	80%	0.8	77%	0.771	S	S	*	*				76.7	133.1	81.7	172.4	0	0	0	0	111.7
4	P	64.3	Low	36.1	Very low	105 Å²	105	142.2 Å²	142.2	68%	0.682	77%	0.766	S	S	*	*			trans	-99.9	-177	-156.4	42.1	-37.7	0	0	0	113.7
5	P	56.2	Low	35.4	Very low	118 Å²	118	139.7 Å²	139.7	77%	0.766	76%	0.764	S	S	*	*				-145.8	168	97.7	38.7	-24.2	0	0	0	114.3
6	T	30.8	Very low	34.9	Very low	129 Å²	129	136 Å²	136	79%	0.791	75%	0.751	S	S	*	*			cis	-162.1	168	-27.9	29.9	0	0	0	0	108.5
7	A	31	Very low	34.5	Very low	89 Å²	89	138.4 Å²	138.4	74%	0.736	75%	0.752	S	S	*	*			trans	-100	-163.4	161.3	0	0	0	0	0	109.4
8	P	45.9	Very low	34.3	Very low	114 Å²	114	138.6 Å²	138.6	74%	0.74	75%	0.752	S	S	*	*			cis	-135.6	-164.2	26.5	33.3	-5.9	0	0	0	112.5
9	L	26.2	Very low	34	Very low	164 Å²	164	136 Å²	136	86%	0.859	75%	0.745	S	S	*	*			cis	-140.1	141	14.4	-90	171.3	0	0	0	112.7
10	Q	29.1	Very low	33.9	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.734	75%	0.746	S	S	*	*			trans	-83.1	174.6	149.5	-88.5	-113.4	0.7	0	0	108.1
11	P	46.5	Very low	33.7	Very low	103 Å²	103	142 Å²	142	67%	0.669	75%	0.751	S	S	*	*			cis	-161	174.9	37.3	45.2	-21.9	0	0	0	121.3
12	F	25.5	Very low	33.5	Very low	153 Å²	153	138.3 Å²	138.3	67%	0.671	74%	0.735	S	S	*	*				86.5	139	125.8	-95.8	-158.6	0	0	0	126.8
13	R	26.5	Very low	33.5	Very low	197 Å²	197	140.3 Å²	140.3	74%	0.743	74%	0.741	S	S	*	*			trans	78.2	149.6	141.3	-74.2	-165.2	-171.7	175.8	4.9	120.9
14	Q	27.4	Very low	33.3	Very low	149 Å²	149	137.5 Å²	137.5	70%	0.696	74%	0.739	S	S	*	*			cis	-174.2	172.2	-37.2	-126.6	177.5	-16.4	0	0	109.4
15	S	25.3	Very low	31.5	Very low	105 Å²	105	138 Å²	138	73%	0.734	75%	0.745	S	S	*	*			trans	70.5	146	144.6	58.6	0	0	0	0	119.3
16	S	27.2	Very low	30.3	Very low	80 Å²	80	139.6 Å²	139.6	56%	0.559	75%	0.745	S	S	*	*			cis	-178.4	169.5	-12.9	49.1	0	0	0	0	112.7
17	F	28.1	Very low	31	Very low	176 Å²	176	143 Å²	143	77%	0.772	75%	0.749	S	S	*	*			trans	71.2	111.6	154.3	-57.9	-46.4	0	0	0	117.3
18	L	30.7	Very low	30.8	Very low	142 Å²	142	147.1 Å²	147.1	74%	0.743	75%	0.745	S	S	*	*				78	142.5	74.1	-72.8	-171	0	0	0	112.4
19	S	28.9	Very low	30.3	Very low	90 Å²	90	145.6 Å²	145.6	63%	0.629	74%	0.743	S	S	*	*			cis	-156	146.5	37.9	-54.7	0	0	0	0	117.4
20	K	31.4	Very low	30.4	Very low	173 Å²	173	148 Å²	148	75%	0.752	75%	0.746	S	S	*	*			trans	75.4	123.8	130.8	-74.4	164.8	-168.7	166.8	0	123.4
21	R	30.8	Very low	30.2	Very low	225 Å²	225	146 Å²	146	85%	0.849	75%	0.749	S	S	*	*			trans	80.7	146.1	135.5	-73.4	-170.9	165.1	177.6	-4.1	120.4
22	L	29.4	Very low	29.4	Very low	146 Å²	146	149.5 Å²	149.5	76%	0.764	76%	0.757	S	S	*	*			cis	-167.1	169.6	-33.1	-124.2	-179.1	0	0	0	109.8
23	K	30.4	Very low	29.9	Very low	200 Å²	200	147.1 Å²	147.1	87%	0.87	76%	0.757	S	S	*	*			trans	78.4	109.6	-168.3	-53.2	175.6	178.9	-179	0	113.1
24	G	27.9	Very low	29.8	Very low	73 Å²	73	148 Å²	148	75%	0.753	77%	0.766	S	S	*	*			cis	81	134.3	-2.8	0	0	0	0	0	114.5
25	S	27	Very low	29.8	Very low	115 Å²	115	148.5 Å²	148.5	80%	0.804	77%	0.773	S	S	*	*			cis	-163.2	146.7	-12.5	-166.4	0	0	0	0	107
26	I	30.3	Very low	30.2	Very low	151 Å²	151	150.6 Å²	150.6	77%	0.774	78%	0.776	S	S	*	*				-173.6	153.5	89	-90.1	167.1	0	0	0	108.9
27	K	44.9	Very low	30.2	Very low	200 Å²	200	158 Å²	158	87%	0.87	79%	0.792	S	S	*	*			trans	-118.4	150.7	166.7	-61.9	178.4	-179.5	178.7	0	110.2
28	R	27.5	Very low	30.3	Very low	176 Å²	176	155.2 Å²	155.2	66%	0.664	79%	0.789	S	S	*	*			trans	-131	154	148.6	-160.6	169.4	-67.4	167.5	6.6	108.4	E1164	R28-E1164 IonicContact CZ-OE1 3.67Å; R28-E1164 IonicContact CZ-OE2 3.73Å; R28-E1164 IonicContact NE-OE1 2.9Å; R28-E1164 IonicContact NH1-OE1 2.73Å; R28-E1164 PolarHBondContact NH1-OE1 3.48Å; R28-E1164 IonicContact NH1-OE2 3.16Å; R28-E1164 PolarHBondContact NH1-OE2 3.42Å; R28-E1164 IonicContact NH2-OE1 2.69Å
29	A	35	Very low	30	Very low	83 Å²	83	154.1 Å²	154.1	69%	0.686	79%	0.793	S	S	*	*			trans	-150.8	-179.3	-165.8	0	0	0	0	0	111.5
30	K	28.1	Very low	30.2	Very low	214 Å²	214	154 Å²	154	93%	0.93	79%	0.793	S	S	*	*			trans	81.6	151.5	-167.9	-50.4	171.4	-179	177.5	0	111.8
31	S	26.2	Very low	30.1	Very low	115 Å²	115	155.2 Å²	155.2	80%	0.804	80%	0.798	S	S	*	*			cis	-140.2	169.7	6.7	60	0	0	0	0	114
32	Q	29.1	Very low	30.1	Very low	176 Å²	176	155.7 Å²	155.7	82%	0.822	80%	0.8	S	S	*	*			trans	-66	-175.7	161.3	-65.1	177.7	-24.9	0	0	111.8
33	P	34.7	Very low	30	Very low	104 Å²	104	158.1 Å²	158.1	68%	0.675	81%	0.807	S	S	*	*			cis	-123.7	168.2	-46.9	32.4	-18.3	0	0	0	111.4
34	K	25.7	Very low	29.7	Very low	214 Å²	214	157.7 Å²	157.7	93%	0.93	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-95.1	117.4	158.4	-87.7	-170.7	173.6	-178.5	0	110
35	L	27.5	Very low	29.7	Very low	161 Å²	161	161.4 Å²	161.4	84%	0.843	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-69.8	149.8	177.3	-86.9	151.2	0	0	0	112.1
36	D	33.1	Very low	29.8	Very low	149 Å²	149	162.9 Å²	162.9	80%	0.797	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-57.7	142.6	164.5	-96.2	-62.4	0	0	0	112.5
37	R	28.2	Very low	29.6	Very low	236 Å²	236	161.7 Å²	161.7	89%	0.891	81%	0.812	S	S	*	*			trans	-137.7	65.6	155.8	-86.3	-165.4	167.3	168.8	-3.7	111.3	S39	R37-S39 PolarHBondContact O-N 3.14Å
38	T	29.1	Very low	28.8	Very low	116 Å²	116	162.3 Å²	162.3	71%	0.712	81%	0.809	S	S	*	*			trans	41.3	78.4	133.6	58.2	0	0	0	0	117.2	S40	T38-S40 PolarHBondContact O-N 3.36Å
39	S	25.8	Very low	28.9	Very low	119 Å²	119	161.9 Å²	161.9	83%	0.832	81%	0.812	S	S	*	*			trans	-88.2	67.9	144.5	63.6	0	0	0	0	108.9	R37	R37-S39 PolarHBondContact O-N 3.14Å
40	S	31.9	Very low	28.9	Very low	89 Å²	89	166.9 Å²	166.9	62%	0.622	81%	0.813	S	S	*	*			trans	-68.3	157.8	173.9	-163.3	0	0	0	0	110.4	T38	T38-S40 PolarHBondContact O-N 3.36Å
41	F	30.6	Very low	28.8	Very low	197 Å²	197	161 Å²	161	86%	0.864	80%	0.799	S	S	*	*	S	Bend	trans	60.9	56.3	178.3	-64.9	-82.3	0	0	0	116.9
42	R	29.7	Very low	28.9	Very low	236 Å²	236	157.4 Å²	157.4	89%	0.891	78%	0.776	S	S	*	*	S	Bend	trans	-162.3	25.4	137.6	-108.7	167.5	-146.1	-87.3	1.8	115.8
43	Q	27.6	Very low	29.1	Very low	196 Å²	196	153.6 Å²	153.6	92%	0.916	76%	0.761	S	S	*	*			trans	-128.7	70.4	169.4	-72.3	-166.7	-3	0	0	111.9
44	M	23.7	Very low	28.9	Very low	192 Å²	192	156.7 Å²	156.7	95%	0.946	77%	0.767	S	S	*	*			trans	-127.4	52.6	161.1	-163.1	174.3	-70.8	0	0	109.6
45	I	28.8	Very low	29.4	Very low	150 Å²	150	151.6 Å²	151.6	77%	0.769	75%	0.75	S	S	*	*			trans	-104.6	117	175.5	-60.3	176.4	0	0	0	108.4
46	L	27.6	Very low	30.1	Very low	147 Å²	147	147.2 Å²	147.2	77%	0.77	72%	0.722	S	S	*	*			trans	17.4	113.9	162.9	-63.5	167.8	0	0	0	118.3	R48	L46-R48 PolarHBondContact O-N 3.23Å
47	P	27.4	Very low	30.1	Very low	126 Å²	126	143.6 Å²	143.6	82%	0.818	71%	0.705	S	S	*	*			trans	-76.1	87	-176.5	31.1	-36	0	0	0	114.3
48	R	27.3	Very low	30.6	Very low	213 Å²	213	140.9 Å²	140.9	80%	0.804	70%	0.695	S	S	*	*			trans	27.7	105.3	154.5	-76.5	-179.3	166.7	161.2	-2.7	117.8	L46	L46-R48 PolarHBondContact O-N 3.23Å
49	F	29.9	Very low	31	Very low	166 Å²	166	137.6 Å²	137.6	73%	0.728	67%	0.673	S	S	*	*			trans	-75.2	119.9	153.6	-73.4	-86.3	0	0	0	110.6
50	R	34.2	Very low	31.4	Very low	189 Å²	189	135.3 Å²	135.3	71%	0.713	65%	0.65	S	S	*	*			trans	-142	85.3	169.4	-84.8	-162.9	172.1	-161.3	-2.3	112.4
51	S	27.8	Very low	31.5	Very low	89 Å²	89	138.7 Å²	138.7	62%	0.622	66%	0.656	S	S	*	*			trans	-174.3	140.6	156.4	-83.1	0	0	0	0	108.4
52	A	27.8	Very low	31.8	Very low	40 Å²	40	131.4 Å²	131.4	33%	0.331	63%	0.629	S	S	.	*			cis	-151.7	152.6	-12	0	0	0	0	0	109.2	K222	A52-K222 HydrophobicContact CB-CD 4Å; A52-K222 VanDerWaalsContact CB-CE 3.48Å; A52-K222 HydrophobicContact CB-CG 4.33Å
53	D	33	Very low	32.2	Very low	96 Å²	96	122.7 Å²	122.7	51%	0.513	60%	0.598	S	S	.	*				-179.9	166.3	121.2	-93.6	-12.8	0	0	0	111.6	R56 T57 K222	D53-R56 HydrophobicContact CB-CB 4.39Å; D53-R56 WeakPolarHBondContact O-CB 3.14Å; D53-R56 PolarHBondContact O-N 3.15Å; D53-T57 PolarHBondContact O-N 2.69Å; D53-T57 PolarHBondContact O-OG1 2.77Å; D53-K222 IonicContact OD1-NZ 2.69Å; D53-K222 PolarHBondContact OD1-NZ 2.91Å
54	Q	30.4	Very low	32.9	Very low	169 Å²	169	121.1 Å²	121.1	79%	0.79	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-36.5	-160.4	-146.9	151.1	-10.9	0	0	112.4	T57	Q54-T57 VanDerWaalsContact O-CB 3.23Å; Q54-T57 WeakPolarHBondContact O-CB 3.08Å; Q54-T57 PolarHBondContact O-N 3.23Å; Q54-T57 PolarHBondContact O-OG1 3.29Å
55	D	36.9	Very low	33.4	Very low	108 Å²	108	120.4 Å²	120.4	58%	0.578	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-29.7	169.7	-61.7	-66.1	0	0	0	112.8	T57 R58	D55-T57 PolarHBondContact O-N 3.26Å; D55-T57 VanDerWaalsContact O-N 3.14Å; D55-R58 WeakPolarHBondContact O-CB 3.43Å; D55-R58 PolarHBondContact O-N 2.85Å; D55-R58 IonicContact OD1-CZ 3.76Å; D55-R58 IonicContact OD1-NE 3.23Å; D55-R58 PolarHBondContact OD1-NE 3.44Å; D55-R58 IonicContact OD1-NH2 3.36Å; D55-R58 PolarHBondContact OD1-NH2 2.69Å
56	R	42	Very low	33.8	Very low	69 Å²	69	114.9 Å²	114.9	26%	0.26	56%	0.557	S	S	.	*	H	α-helix	trans	-59.9	-22.6	169.6	-173.3	174.8	168.6	128.9	5.5	112	D53 R58 M60 I99	D53-R56 HydrophobicContact CB-CB 4.39Å; D53-R56 WeakPolarHBondContact O-CB 3.14Å; D53-R56 PolarHBondContact O-N 3.15Å; R56-R58 VanDerWaalsContact C-N 3.34Å; R56-M60 HydrophobicContact CG-CG 4.35Å; R56-M60 WeakPolarHBondContact O-CB 3.49Å; R56-M60 WeakPolarHBondContact O-CG 3.23Å; R56-M60 PolarHBondContact O-N 2.71Å; R56-I99 PolarHBondContact NH2-O 3.49Å
57	T	33.5	Very low	34.4	Very low	72 Å²	72	114.8 Å²	114.8	44%	0.442	55%	0.553	S	S	.	*	H	α-helix	trans	-64.2	-33.6	169.8	-23.5	0	0	0	0	113	D53 Q54 D55 Q61	D53-T57 PolarHBondContact O-N 2.69Å; D53-T57 PolarHBondContact O-OG1 2.77Å; Q54-T57 VanDerWaalsContact O-CB 3.23Å; Q54-T57 WeakPolarHBondContact O-CB 3.08Å; Q54-T57 PolarHBondContact O-N 3.23Å; Q54-T57 PolarHBondContact O-OG1 3.29Å; D55-T57 PolarHBondContact O-N 3.26Å; D55-T57 VanDerWaalsContact O-N 3.14Å; T57-Q61 WeakPolarHBondContact O-CG 3.23Å; T57-Q61 PolarHBondContact O-N 2.93Å
58	R	36.9	Very low	35.3	Very low	179 Å²	179	112.7 Å²	112.7	68%	0.675	54%	0.541	S	S	*	.	H	α-helix	trans	-68	-47.7	177.1	-52.7	-175.5	-159.3	-124.2	7.8	110.5	D55 R56 M60 Q61 S62	D55-R58 WeakPolarHBondContact O-CB 3.43Å; D55-R58 PolarHBondContact O-N 2.85Å; D55-R58 IonicContact OD1-CZ 3.76Å; D55-R58 IonicContact OD1-NE 3.23Å; D55-R58 PolarHBondContact OD1-NE 3.44Å; D55-R58 IonicContact OD1-NH2 3.36Å; D55-R58 PolarHBondContact OD1-NH2 2.69Å; R56-R58 VanDerWaalsContact C-N 3.34Å; R58-M60 VanDerWaalsContact C-N 3.33Å; R58-M60 PolarHBondContact O-N 3.23Å; R58-Q61 WeakPolarHBondContact O-CB 3.43Å; R58-Q61 PolarHBondContact O-N 3.36Å; R58-S62 PolarHBondContact O-N 3.15Å
59	L	37.9	Very low	36.7	Very low	48 Å²	48	105.2 Å²	105.2	25%	0.251	52%	0.515	S	S	.	.	H	α-helix	trans	-59.9	-44.2	176.2	-160.4	72.2	0	0	0	111.1	Q61 S62 F63 T114	L59-Q61 PolarHBondContact O-N 3.21Å; L59-S62 PolarHBondContact O-N 3.35Å; L59-S62 VanDerWaalsContact O-N 3.09Å; L59-S62 PolarHBondContact O-OG 3.49Å; L59-F63 WeakPolarHBondContact O-CD2 3.35Å; L59-F63 WeakPolarHBondContact O-CE2 3.47Å; L59-T114 HydrophobicContact CD1-CG2 3.84Å
60	M	35.4	Very low	38.1	Very low	70 Å²	70	104.3 Å²	104.3	35%	0.345	51%	0.513	S	S	.	.	H	α-helix	trans	-68.1	-12.6	175	-69.1	-110.1	73.8	0	0	114.7	R56 R58 F63	R56-M60 HydrophobicContact CG-CG 4.35Å; R56-M60 WeakPolarHBondContact O-CB 3.49Å; R56-M60 WeakPolarHBondContact O-CG 3.23Å; R56-M60 PolarHBondContact O-N 2.71Å; R58-M60 VanDerWaalsContact C-N 3.33Å; R58-M60 PolarHBondContact O-N 3.23Å; M60-F63 HydrophobicContact CE-CD2 3.87Å; M60-F63 HydrophobicContact CE-CE2 3.6Å; M60-F63 HydrophobicContact CE-CZ 4.28Å
61	Q	33.3	Very low	39.2	Very low	161 Å²	161	97.6 Å²	97.6	75%	0.752	50%	0.495	S	S	*	.	H	α-helix	trans	-89.5	-12	171.2	-81.6	178	-45.9	0	0	113.1	T57 R58 L59	T57-Q61 WeakPolarHBondContact O-CG 3.23Å; T57-Q61 PolarHBondContact O-N 2.93Å; R58-Q61 WeakPolarHBondContact O-CB 3.43Å; R58-Q61 PolarHBondContact O-N 3.36Å; L59-Q61 PolarHBondContact O-N 3.21Å
62	S	37.4	Very low	40.7	Very low	43 Å²	43	93.5 Å²	93.5	30%	0.301	47%	0.466	S	S	.	.			trans	-89.3	-2.6	-179.4	76.7	0	0	0	0	115.1	R58 L59 K64	R58-S62 PolarHBondContact O-N 3.15Å; L59-S62 PolarHBondContact O-N 3.35Å; L59-S62 VanDerWaalsContact O-N 3.09Å; L59-S62 PolarHBondContact O-OG 3.49Å; S62-K64 PolarHBondContact O-N 2.96Å
63	F	38.4	Very low	42.3	Very low	53 Å²	53	95.2 Å²	95.2	23%	0.232	47%	0.469	C	S	.	.			trans	-68.8	89.9	179.1	-77.5	-90.1	0	0	0	111.6	L59 M60 E65 L100 C116	L59-F63 WeakPolarHBondContact O-CD2 3.35Å; L59-F63 WeakPolarHBondContact O-CE2 3.47Å; M60-F63 HydrophobicContact CE-CD2 3.87Å; M60-F63 HydrophobicContact CE-CE2 3.6Å; M60-F63 HydrophobicContact CE-CZ 4.28Å; F63-E65 PolarHBondContact O-N 2.92Å; F63-L100 HydrophobicContact CE1-CD1 4.03Å; F63-L100 HydrophobicContact CE2-CD2 4.28Å; F63-L100 HydrophobicContact CZ-CD1 3.69Å; F63-L100 HydrophobicContact CZ-CD2 3.68Å; F63-L100 HydrophobicContact CZ-CG 4.28Å; F63-C116 HydrophobicContact CE1-CB 3.96Å; F63-C116 HydrophobicContact CE2-CB 4.18Å; F63-C116 HydrophobicContact CZ-CB 3.59Å
64	K	41.2	Very low	43.7	Very low	163 Å²	163	93.2 Å²	93.2	71%	0.709	46%	0.463	S	S	*	.			trans	-69.9	110.7	153	-70.7	-177.3	177.2	179.5	0	107.5	S62 S66	S62-K64 PolarHBondContact O-N 2.96Å; K64-S66 PolarHBondContact O-N 3.03Å
65	E	34.2	Very low	45.1	Very low	177 Å²	177	87.2 Å²	87.2	83%	0.827	44%	0.439	S	S	*	.			trans	-71.1	71.2	159.7	-74	-178.3	123.9	0	0	108.5	F63 H67	F63-E65 PolarHBondContact O-N 2.92Å; E65-H67 PolarHBondContact O-N 3.2Å
66	S	37.5	Very low	46.2	Very low	35 Å²	35	86.6 Å²	86.6	25%	0.245	44%	0.443	C	S	.	.			trans	-90.3	92.5	-178.8	54.3	0	0	0	0	110.3	K64 H69	K64-S66 PolarHBondContact O-N 3.03Å; S66-H69 PolarHBondContact OG-CD2 3.21Å
67	H	39.7	Very low	47.4	Very low	144 Å²	144	85.1 Å²	85.1	67%	0.667	44%	0.443	S	S	*	.	S	Bend	trans	-62.4	139.2	157.6	-62.8	-37.7	0	0	0	109.2	E65	E65-H67 PolarHBondContact O-N 3.2Å
68	S	46.3	Very low	48.9	Very low	82 Å²	82	81.7 Å²	81.7	57%	0.573	42%	0.422	S	S	*	.			trans	54.2	80.8	-179.5	51.2	0	0	0	0	115.3
69	H	57.3	Low	50.2	Low	57 Å²	57	73.5 Å²	73.5	26%	0.264	39%	0.393	S	S	.	.			trans	-99.2	70.6	151.1	-86.9	-48.4	0	0	0	109.4	S66 S71 L72 W128	S66-H69 PolarHBondContact OG-CD2 3.21Å; H69-S71 PolarHBondContact O-N 2.67Å; H69-L72 HydrophobicContact CB-CD1 3.77Å; H69-L72 HydrophobicContact CB-CG 3.94Å; H69-L72 WeakPolarHBondContact O-CB 3.48Å; H69-L72 PolarHBondContact O-N 3.17Å; H69-W128 HydrophobicContact CB-CH2 4.01Å; H69-W128 HydrophobicContact CB-CZ3 4.37Å
70	E	58.3	Low	51.6	Low	146 Å²	146	78.7 Å²	78.7	68%	0.682	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.4	176.6	-65	-177.5	164.8	0	0	112.2	L72 L73	E70-L72 PolarHBondContact O-N 3.28Å; E70-L72 VanDerWaalsContact O-N 3.15Å; E70-L73 HydrophobicContact CB-CD1 4.44Å; E70-L73 HydrophobicContact CG-CD1 4.44Å; E70-L73 VanDerWaalsContact O-CB 3.25Å; E70-L73 WeakPolarHBondContact O-CB 3.35Å; E70-L73 PolarHBondContact O-N 3.35Å
71	S	56.9	Low	53	Low	49 Å²	49	78 Å²	78	34%	0.343	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-48.5	-35.1	166.4	-51.3	0	0	0	0	113.7	H69 L73 S74 S77 A78	H69-S71 PolarHBondContact O-N 2.67Å; S71-L73 PolarHBondContact O-N 2.89Å; S71-S74 PolarHBondContact O-N 3.14Å; S71-S77 WeakPolarHBondContact CB-OG 3.25Å; S71-S77 CarbonylContact O-C 3.56Å; S71-S77 WeakPolarHBondContact O-CB 3.42Å; S71-A78 PolarHBondContact O-N 3.02Å; S71-A78 VanDerWaalsContact O-N 3.09Å
72	L	59.9	Low	54.7	Low	2 Å²	2	71.1 Å²	71.1	1%	0.01	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-78.7	-6.3	179.5	-58.1	177.3	0	0	0	113.1	H69 E70 A78 L82 W128 N131 L132	H69-L72 HydrophobicContact CB-CD1 3.77Å; H69-L72 HydrophobicContact CB-CG 3.94Å; H69-L72 WeakPolarHBondContact O-CB 3.48Å; H69-L72 PolarHBondContact O-N 3.17Å; E70-L72 PolarHBondContact O-N 3.28Å; E70-L72 VanDerWaalsContact O-N 3.15Å; L72-A78 HydrophobicContact CD2-CB 3.96Å; L72-L82 HydrophobicContact CD2-CD1 3.95Å; L72-L82 HydrophobicContact CD2-CG 4.08Å; L72-W128 HydrophobicContact CB-CD2 4.02Å; L72-W128 HydrophobicContact CB-CE3 4.11Å; L72-W128 HydrophobicContact CB-CG 4.38Å; L72-W128 HydrophobicContact CD1-CD2 4.25Å; L72-W128 HydrophobicContact CD1-CE3 3.48Å; L72-W128 VanDerWaalsContact CD1-CE3 3.48Å; L72-W128 HydrophobicContact CD1-CH2 4.34Å; L72-W128 HydrophobicContact CD1-CZ3 3.54Å; L72-W128 HydrophobicContact CG-CE3 4.43Å; L72-N131 PolarHBondContact O-ND2 3.19Å; L72-L132 HydrophobicContact CD2-CD2 4.25Å
73	L	61.2	Low	56	Low	76 Å²	76	74 Å²	74	40%	0.398	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-83.6	-13.7	173.7	-61.2	174	0	0	0	113.3	E70 S71 K127 N131	E70-L73 HydrophobicContact CB-CD1 4.44Å; E70-L73 HydrophobicContact CG-CD1 4.44Å; E70-L73 VanDerWaalsContact O-CB 3.25Å; E70-L73 WeakPolarHBondContact O-CB 3.35Å; E70-L73 PolarHBondContact O-N 3.35Å; S71-L73 PolarHBondContact O-N 2.89Å; L73-K127 HydrophobicContact CD2-CD 4.41Å; L73-N131 VanDerWaalsContact CA-ND2 3.33Å; L73-N131 WeakPolarHBondContact CA-ND2 3.38Å; L73-N131 PolarHBondContact O-ND2 3.11Å
74	S	63.1	Low	57.4	Low	55 Å²	55	71.7 Å²	71.7	39%	0.385	39%	0.392	S	S	.	.	S	Bend	trans	-115.3	123	175.6	175.2	0	0	0	0	110.1	S71 S76 S77 A78	S71-S74 PolarHBondContact O-N 3.14Å; S74-S76 VanDerWaalsContact C-N 3.28Å; S74-S76 PolarHBondContact O-N 3.42Å; S74-S77 PolarHBondContact O-N 3.38Å; S74-A78 VanDerWaalsContact O-CB 3.27Å; S74-A78 WeakPolarHBondContact O-CB 3.41Å; S74-A78 PolarHBondContact O-N 3.05Å
75	P	59.3	Low	58.3	Low	43 Å²	43	68.6 Å²	68.6	28%	0.279	39%	0.386	S	S	.	.	H	α-helix	trans	-52.3	-40.9	-176.9	-29.7	36.3	0	0	0	114.3	A78 A79 A135	P75-A78 PolarHBondContact O-N 3.08Å; P75-A79 WeakPolarHBondContact O-CB 3.28Å; P75-A79 PolarHBondContact O-N 3.14Å; P75-A135 HydrophobicContact CB-CB 4.16Å; P75-A135 WeakPolarHBondContact O-CB 3.31Å
76	S	61.2	Low	59.2	Low	95 Å²	95	67.4 Å²	67.4	66%	0.664	39%	0.385	S	S	*	.	H	α-helix	trans	-66.4	-46.9	-179.8	-45	0	0	0	0	112.6	S74 A78 A79 E80	S74-S76 VanDerWaalsContact C-N 3.28Å; S74-S76 PolarHBondContact O-N 3.42Å; S76-A78 VanDerWaalsContact C-N 3.28Å; S76-A78 PolarHBondContact O-N 2.79Å; S76-A79 PolarHBondContact O-N 3.15Å; S76-E80 PolarHBondContact O-N 3.09Å; S76-E80 VanDerWaalsContact O-N 3.17Å
77	S	66.8	Low	60.4	Low	37 Å²	37	66.9 Å²	66.9	26%	0.259	38%	0.379	S	S	.	.	H	α-helix	trans	-72.6	-25.9	178.6	-170.1	0	0	0	0	111.6	S71 S74 A81	S71-S77 WeakPolarHBondContact CB-OG 3.25Å; S71-S77 CarbonylContact O-C 3.56Å; S71-S77 WeakPolarHBondContact O-CB 3.42Å; S74-S77 PolarHBondContact O-N 3.38Å; S77-A81 WeakPolarHBondContact O-CB 3.41Å; S77-A81 PolarHBondContact O-N 2.86Å
78	A	64.3	Low	61.6	Low	0 Å²	0	66 Å²	66	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-70.6	-37.7	173.1	0	0	0	0	0	112.4	S71 L72 S74 P75 S76 L82 L132	S71-A78 PolarHBondContact O-N 3.02Å; S71-A78 VanDerWaalsContact O-N 3.09Å; L72-A78 HydrophobicContact CD2-CB 3.96Å; S74-A78 VanDerWaalsContact O-CB 3.27Å; S74-A78 WeakPolarHBondContact O-CB 3.41Å; S74-A78 PolarHBondContact O-N 3.05Å; P75-A78 PolarHBondContact O-N 3.08Å; S76-A78 VanDerWaalsContact C-N 3.28Å; S76-A78 PolarHBondContact O-N 2.79Å; A78-L82 PolarHBondContact O-N 2.87Å; A78-L132 HydrophobicContact CB-CD2 3.72Å
79	A	64.9	Low	62.7	Low	8 Å²	8	69 Å²	69	7%	0.066	39%	0.385	C	S	.	.	H	α-helix	trans	-64.3	-46.8	174.6	0	0	0	0	0	111.5	P75 S76 D83 L84 T85 A135	P75-A79 WeakPolarHBondContact O-CB 3.28Å; P75-A79 PolarHBondContact O-N 3.14Å; S76-A79 PolarHBondContact O-N 3.15Å; A79-D83 WeakPolarHBondContact O-CA 3.46Å; A79-D83 PolarHBondContact O-N 3Å; A79-L84 PolarHBondContact O-N 2.87Å; A79-T85 HydrophobicContact CB-CG2 3.64Å; A79-A135 HydrophobicContact CB-CB 4.16Å
80	E	66.9	Low	63.8	Low	157 Å²	157	66.8 Å²	66.8	73%	0.734	38%	0.377	S	S	*	.	H	α-helix	trans	-65.5	-45.6	178.2	-174.7	179.5	-155.6	0	0	112.3	S76 L82 D83	S76-E80 PolarHBondContact O-N 3.09Å; S76-E80 VanDerWaalsContact O-N 3.17Å; E80-L82 PolarHBondContact O-N 3.26Å; E80-D83 PolarHBondContact O-N 2.88Å
81	A	65.9	Low	64.8	Low	56 Å²	56	63.1 Å²	63.1	46%	0.463	36%	0.361	S	S	.	.	H	α-helix	trans	-67.7	-18.1	-177.1	0	0	0	0	0	114.5	S77	S77-A81 WeakPolarHBondContact O-CB 3.41Å; S77-A81 PolarHBondContact O-N 2.86Å
82	L	68.3	Low	66.1	Low	16 Å²	16	61.5 Å²	61.5	8%	0.084	35%	0.349	C	S	.	.	H	α-helix	trans	-118.5	-2.5	-179	-65.5	-174.9	0	0	0	114.9	L72 A78 E80 L84 V108 K115 F117 L132	L72-L82 HydrophobicContact CD2-CD1 3.95Å; L72-L82 HydrophobicContact CD2-CG 4.08Å; A78-L82 PolarHBondContact O-N 2.87Å; E80-L82 PolarHBondContact O-N 3.26Å; L82-L84 HydrophobicContact CB-CD1 3.81Å; L82-L84 HydrophobicContact CB-CG 3.8Å; L82-L84 HydrophobicContact CD1-CD1 4.15Å; L82-V108 HydrophobicContact CD1-CG2 4.28Å; L82-K115 HydrophobicContact CD2-CD 4.47Å; L82-K115 PolarHBondContact O-NZ 2.9Å; L82-F117 HydrophobicContact CD1-CE2 4.43Å; L82-F117 HydrophobicContact CD1-CZ 4.15Å; L82-F117 HydrophobicContact CD2-CE1 4.21Å; L82-F117 HydrophobicContact CD2-CZ 3.63Å; L82-L132 HydrophobicContact CD1-CD1 4.2Å; L82-L132 HydrophobicContact CD1-CD2 3.7Å
83	D	65.1	Low	67.1	Low	103 Å²	103	62.2 Å²	62.2	55%	0.551	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	46	-176.8	-157.5	19.7	0	0	0	113.3	A79 E80	A79-D83 WeakPolarHBondContact O-CA 3.46Å; A79-D83 PolarHBondContact O-N 3Å; E80-D83 PolarHBondContact O-N 2.88Å
84	L	68.1	Low	68	Low	4 Å²	4	61.1 Å²	61.1	2%	0.021	35%	0.349	C	S	.	.			trans	-94.2	-8.4	-174.4	-66.5	170.7	0	0	0	114.2	A79 L82 L86 D87 A90 V108 T110 L132 V136	A79-L84 PolarHBondContact O-N 2.87Å; L82-L84 HydrophobicContact CB-CD1 3.81Å; L82-L84 HydrophobicContact CB-CG 3.8Å; L82-L84 HydrophobicContact CD1-CD1 4.15Å; L84-L86 PolarHBondContact O-N 2.85Å; L84-L86 VanDerWaalsContact O-N 3.14Å; L84-D87 PolarHBondContact O-N 2.97Å; L84-A90 HydrophobicContact CD2-CB 3.68Å; L84-V108 HydrophobicContact CD2-CG1 4.03Å; L84-T110 HydrophobicContact CD2-CG2 3.6Å; L84-L132 HydrophobicContact CD1-CD2 3.59Å; L84-V136 HydrophobicContact CB-CG2 4.1Å; L84-V136 HydrophobicContact CD1-CG2 4.2Å; L84-V136 HydrophobicContact CD2-CG2 4.23Å; L84-V136 HydrophobicContact CG-CG2 4.42Å
85	T	58.5	Low	69	Low	98 Å²	98	58.8 Å²	58.8	60%	0.601	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-7.1	-178.3	49.4	0	0	0	0	114	A79	A79-T85 HydrophobicContact CB-CG2 3.64Å
86	L	53.9	Low	70	Confident	152 Å²	152	59 Å²	59	80%	0.796	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	3.3	-176.3	-61.9	174.4	0	0	0	113.4	L84	L84-L86 PolarHBondContact O-N 2.85Å; L84-L86 VanDerWaalsContact O-N 3.14Å
87	D	63.2	Low	70.8	Confident	24 Å²	24	56.2 Å²	56.2	13%	0.128	31%	0.31	C	S	.	.			trans	-127.6	81.4	-170.7	-165.6	-5.5	0	0	0	112.2	L84 D89 A90 T110 A111	L84-D87 PolarHBondContact O-N 2.97Å; D87-D89 PolarHBondContact O-N 3.41Å; D87-D89 PolarHBondContact OD1-N 3.33Å; D87-A90 HydrophobicContact CB-CB 4.3Å; D87-A90 VanDerWaalsContact O-CB 3.23Å; D87-A90 WeakPolarHBondContact O-CB 3.5Å; D87-A90 PolarHBondContact O-N 2.92Å; D87-A90 VanDerWaalsContact O-N 3.15Å; D87-A90 PolarHBondContact OD1-N 3.21Å; D87-T110 WeakPolarHBondContact OD2-CA 3.44Å; D87-T110 WeakPolarHBondContact OD2-CB 3.44Å; D87-A111 PolarHBondContact OD2-N 2.71Å
88	E	65	Low	71.3	Confident	127 Å²	127	55.7 Å²	55.7	59%	0.593	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-22	174.3	-84	-81.2	-173.5	0	0	113.4	A90 K137	E88-A90 VanDerWaalsContact C-N 3.33Å; E88-K137 WeakPolarHBondContact O-CE 3.14Å; E88-K137 PolarHBondContact O-NZ 2.73Å; E88-K137 IonicContact OE2-NZ 3.77Å; E88-K137 PolarHBondContact OE2-NZ 2.9Å
89	D	69.3	Low	72	Confident	144 Å²	144	56.6 Å²	56.6	77%	0.77	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	5.4	179.1	-75	-38.3	0	0	0	112.7	D87 I91	D87-D89 PolarHBondContact O-N 3.41Å; D87-D89 PolarHBondContact OD1-N 3.33Å; D89-I91 WeakPolarHBondContact O-CG1 3.27Å; D89-I91 PolarHBondContact O-N 2.95Å; D89-I91 VanDerWaalsContact O-N 3.14Å
90	A	80.4	Confident	72.5	Confident	11 Å²	11	57.7 Å²	57.7	9%	0.091	32%	0.316	C	S	.	.			trans	-60.4	114.8	-179.3	0	0	0	0	0	113.1	L84 D87 E88 T109 T110 V136	L84-A90 HydrophobicContact CD2-CB 3.68Å; D87-A90 HydrophobicContact CB-CB 4.3Å; D87-A90 VanDerWaalsContact O-CB 3.23Å; D87-A90 WeakPolarHBondContact O-CB 3.5Å; D87-A90 PolarHBondContact O-N 2.92Å; D87-A90 VanDerWaalsContact O-N 3.15Å; D87-A90 PolarHBondContact OD1-N 3.21Å; E88-A90 VanDerWaalsContact C-N 3.33Å; A90-T109 CarbonylContact C-O 3.49Å; A90-T109 VanDerWaalsContact CA-O 3.28Å; A90-T109 WeakPolarHBondContact CA-O 3.4Å; A90-T110 HydrophobicContact CB-CG2 4.3Å; A90-V136 HydrophobicContact CB-CG1 4.38Å; A90-V136 HydrophobicContact CB-CG2 4.12Å
91	I	78.8	Confident	72.7	Confident	69 Å²	69	53.5 Å²	53.5	35%	0.354	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	107.1	-179	-51.8	-179	0	0	0	109.8	D89 V108 T109	D89-I91 WeakPolarHBondContact O-CG1 3.27Å; D89-I91 PolarHBondContact O-N 2.95Å; D89-I91 VanDerWaalsContact O-N 3.14Å; I91-V108 WeakPolarHBondContact O-CA 3.42Å; I91-T109 PolarHBondContact N-O 2.66Å; I91-T109 PolarHBondContact O-N 2.89Å
92	I	84.1	Confident	73.1	Confident	14 Å²	14	55 Å²	55	7%	0.072	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	112.5	174.9	-56.8	143.7	0	0	0	108.9	F106 E107 V108 I129 L132 Q133 V136	I92-F106 HydrophobicContact CG2-CD2 4.45Å; I92-E107 WeakPolarHBondContact CA-O 3.27Å; I92-V108 HydrophobicContact CG1-CG1 3.96Å; I92-V108 HydrophobicContact CG1-CG2 4.19Å; I92-V108 HydrophobicContact CG2-CG2 4.36Å; I92-I129 HydrophobicContact CG2-CB 4.38Å; I92-I129 HydrophobicContact CG2-CG1 4.34Å; I92-I129 HydrophobicContact CG2-CG2 4.13Å; I92-L132 HydrophobicContact CD1-CB 3.68Å; I92-L132 HydrophobicContact CG1-CB 4.24Å; I92-L132 HydrophobicContact CG2-CB 4.19Å; I92-L132 HydrophobicContact CG2-CD1 4.46Å; I92-Q133 HydrophobicContact CB-CG 4.27Å; I92-Q133 HydrophobicContact CD1-CG 4.18Å; I92-Q133 HydrophobicContact CG2-CG 4.49Å; I92-Q133 PolarHBondContact O-NE2 3.4Å; I92-V136 HydrophobicContact CD1-CG2 3.75Å
93	K	80.8	Confident	73.6	Confident	17 Å²	17	58.2 Å²	58.2	7%	0.074	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	148.2	-178.9	65.3	176.1	178.6	176.9	0	113.1	F106 E107 Y177	K93-F106 WeakPolarHBondContact O-CA 3.43Å; K93-F106 WeakPolarHBondContact O-CB 3.41Å; K93-E107 HydrophobicContact CD-CG 4.36Å; K93-E107 WeakPolarHBondContact CE-OE1 3.37Å; K93-E107 HydrophobicContact CG-CG 3.63Å; K93-E107 PolarHBondContact N-O 2.95Å; K93-E107 IonicContact NZ-OE1 3.39Å; K93-E107 PolarHBondContact O-N 3.21Å; K93-Y177 HydrophobicContact CD-CE1 3.79Å
94	P	81.4	Confident	74.3	Confident	54 Å²	54	55.1 Å²	55.1	35%	0.351	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	143.6	170.8	28.5	-34.1	0	0	0	110.5	I129	P94-I129 HydrophobicContact CB-CD1 3.8Å; P94-I129 HydrophobicContact CG-CD1 4.41Å
95	V	82.2	Confident	75.2	Confident	6 Å²	6	55 Å²	55	4%	0.036	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123	176.3	172.8	0	0	0	0	108	S97 I99 L100 C105 E107	V95-S97 PolarHBondContact O-N 3.4Å; V95-I99 HydrophobicContact CG1-CB 4Å; V95-I99 HydrophobicContact CG1-CD1 4.24Å; V95-I99 HydrophobicContact CG1-CG2 4.22Å; V95-L100 HydrophobicContact CB-CD1 4.47Å; V95-L100 HydrophobicContact CG1-CD1 3.7Å; V95-L100 HydrophobicContact CG1-CG 3.87Å; V95-C105 HydrophobicContact CB-CB 4.04Å; V95-C105 HydrophobicContact CG1-CB 4.39Å; V95-C105 PolarHBondContact N-O 3.05Å; V95-E107 HydrophobicContact CG2-CB 3.73Å; V95-E107 HydrophobicContact CG2-CG 3.76Å; V95-E107 WeakPolarHBondContact CG2-OE2 3.45Å
96	H	82	Confident	76.5	Confident	48 Å²	48	50.3 Å²	50.3	22%	0.222	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-63.5	136.9	179.6	-163.9	-91	0	0	0	110.8	S98 I99 Y177 A178 F195 Q482	H96-S98 PolarHBondContact ND1-OG 2.86Å; H96-S98 PolarHBondContact O-N 3.09Å; H96-S98 VanDerWaalsContact O-N 3.12Å; H96-I99 WeakPolarHBondContact O-CB 3.34Å; H96-I99 PolarHBondContact O-N 3.17Å; H96-Y177 WeakPolarHBondContact CB-O 3.43Å; H96-A178 HydrophobicContact CB-CB 3.85Å; H96-F195 AromaticContact CE1-CD1 3.95Å; H96-F195 AromaticContact CE1-CE1 3.7Å; H96-F195 AromaticContact NE2-CD1 3.77Å; H96-F195 AromaticContact NE2-CE1 3.98Å; H96-Q482 PolarHBondContact CE1-OE1 2.65Å
97	S	76.9	Confident	78	Confident	36 Å²	36	44 Å²	44	25%	0.252	25%	0.245	S	C	.	.	H	α-helix	trans	-55.2	-37.6	-171.3	54.7	0	0	0	0	113	V95 I99 L100 G101 Q102	V95-S97 PolarHBondContact O-N 3.4Å; S97-I99 VanDerWaalsContact C-N 3.25Å; S97-I99 PolarHBondContact O-N 3.38Å; S97-L100 PolarHBondContact O-N 2.66Å; S97-G101 WeakPolarHBondContact O-CA 3.16Å; S97-G101 PolarHBondContact O-N 3.08Å; S97-Q102 WeakPolarHBondContact CA-O 3.32Å; S97-Q102 PolarHBondContact O-N 3.3Å
98	S	77.4	Confident	79.1	Confident	25 Å²	25	42.9 Å²	42.9	18%	0.175	24%	0.239	C	C	.	.	H	α-helix	trans	-69	-10.6	177.7	65.3	0	0	0	0	115.8	H96 R179	H96-S98 PolarHBondContact ND1-OG 2.86Å; H96-S98 PolarHBondContact O-N 3.09Å; H96-S98 VanDerWaalsContact O-N 3.12Å; S98-R179 WeakPolarHBondContact CB-O 3.37Å; S98-R179 PolarHBondContact OG-N 3.47Å; S98-R179 VanDerWaalsContact OG-N 3.07Å; S98-R179 PolarHBondContact OG-O 3.19Å
99	I	79.2	Confident	80	Confident	19 Å²	19	38.3 Å²	38.3	10%	0.097	22%	0.219	C	C	.	.	H	α-helix	trans	-71.1	-51.6	168.1	-67	-177.6	0	0	0	109.9	R56 V95 H96 S97 L176 Y177	R56-I99 PolarHBondContact NH2-O 3.49Å; V95-I99 HydrophobicContact CG1-CB 4Å; V95-I99 HydrophobicContact CG1-CD1 4.24Å; V95-I99 HydrophobicContact CG1-CG2 4.22Å; H96-I99 WeakPolarHBondContact O-CB 3.34Å; H96-I99 PolarHBondContact O-N 3.17Å; S97-I99 VanDerWaalsContact C-N 3.25Å; S97-I99 PolarHBondContact O-N 3.38Å; I99-L176 HydrophobicContact CD1-CD2 4.3Å; I99-L176 HydrophobicContact CD1-CG 4.05Å; I99-L176 HydrophobicContact CG1-CD2 4.13Å; I99-L176 HydrophobicContact CG1-CG 4.23Å; I99-L176 HydrophobicContact CG2-CD2 4.24Å; I99-Y177 WeakPolarHBondContact CD1-O 3.49Å
100	L	75.5	Confident	80.7	Confident	31 Å²	31	32.1 Å²	32.1	16%	0.162	19%	0.187	C	C	.	.	H	α-helix	trans	-97.2	-21.4	-170.2	-65.2	176.6	0	0	0	113.7	F63 V95 S97 Q102 C105	F63-L100 HydrophobicContact CE1-CD1 4.03Å; F63-L100 HydrophobicContact CE2-CD2 4.28Å; F63-L100 HydrophobicContact CZ-CD1 3.69Å; F63-L100 HydrophobicContact CZ-CD2 3.68Å; F63-L100 HydrophobicContact CZ-CG 4.28Å; V95-L100 HydrophobicContact CB-CD1 4.47Å; V95-L100 HydrophobicContact CG1-CD1 3.7Å; V95-L100 HydrophobicContact CG1-CG 3.87Å; S97-L100 PolarHBondContact O-N 2.66Å; L100-Q102 VanDerWaalsContact C-N 3.34Å; L100-C105 HydrophobicContact CD1-CB 3.73Å
101	G	71	Confident	80.5	Confident	69 Å²	69	36.3 Å²	36.3	71%	0.711	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.8	20.3	-168.7	0	0	0	0	0	113.1	S97	S97-G101 WeakPolarHBondContact O-CA 3.16Å; S97-G101 PolarHBondContact O-N 3.08Å
102	Q	74	Confident	80.4	Confident	87 Å²	87	37.1 Å²	37.1	41%	0.407	23%	0.233	S	C	.	.			trans	-139.3	136.7	-177.4	-174.9	168.5	4.7	0	0	108.9	S97 L100 A118	S97-Q102 WeakPolarHBondContact CA-O 3.32Å; S97-Q102 PolarHBondContact O-N 3.3Å; L100-Q102 VanDerWaalsContact C-N 3.34Å; Q102-A118 HydrophobicContact CG-CB 4.47Å
103	E	78	Confident	80.1	Confident	84 Å²	84	38 Å²	38	39%	0.393	25%	0.246	S	C	.	.	S	Bend	trans	-75.6	168.2	179	-59.7	-170.5	130.6	0	0	111.8	C105	E103-C105 PolarHBondContact O-N 3.47Å; E103-C105 PolarHBondContact O-SG 2.69Å
104	Y	81.4	Confident	80.1	Confident	38 Å²	38	39.7 Å²	39.7	15%	0.149	26%	0.258	C	S	.	.	S	Bend	trans	52.8	33.3	170.4	-35.4	-57.1	0	0	0	115.7	C119 S121 A122 K377	Y104-C119 WeakPolarHBondContact O-CB 3.46Å; Y104-C119 PolarHBondContact O-N 2.85Å; Y104-S121 WeakPolarHBondContact CB-O 3.45Å; Y104-A122 VanDerWaalsContact CD1-CA 3.46Å; Y104-A122 HydrophobicContact CD1-CB 3.67Å; Y104-A122 HydrophobicContact CE1-CB 3.89Å; Y104-K377 WeakPolarHBondContact OH-CE 3.48Å; Y104-K377 PolarHBondContact OH-NZ 3.27Å
105	C	85.7	Confident	80.1	Confident	1 Å²	1	40 Å²	40	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	155	177.8	-64.6	0	0	0	0	112.6	V95 L100 E103 F117 R125	V95-C105 HydrophobicContact CB-CB 4.04Å; V95-C105 HydrophobicContact CG1-CB 4.39Å; V95-C105 PolarHBondContact N-O 3.05Å; L100-C105 HydrophobicContact CD1-CB 3.73Å; E103-C105 PolarHBondContact O-N 3.47Å; E103-C105 PolarHBondContact O-SG 2.69Å; C105-F117 CarbonylContact C-O 3.53Å; C105-F117 WeakPolarHBondContact CA-O 3.35Å; C105-F117 WeakPolarHBondContact CB-O 3.33Å; C105-R125 VanDerWaalsContact O-CD 3.25Å; C105-R125 WeakPolarHBondContact O-CD 3.41Å
106	F	86.1	Confident	80.2	Confident	0 Å²	0	40 Å²	40	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	164.5	169.4	75.3	-88.1	0	0	0	111.1	I92 K93 V108 C116 F117 R125 W128 I129 L132	I92-F106 HydrophobicContact CG2-CD2 4.45Å; K93-F106 WeakPolarHBondContact O-CA 3.43Å; K93-F106 WeakPolarHBondContact O-CB 3.41Å; F106-V108 HydrophobicContact CD2-CG2 4.04Å; F106-V108 HydrophobicContact CE2-CG2 3.63Å; F106-C116 WeakPolarHBondContact O-CA 3.5Å; F106-F117 HydrophobicContact CD1-CB 3.89Å; F106-F117 HydrophobicContact CD2-CD2 4.16Å; F106-F117 HydrophobicContact CE1-CB 3.49Å; F106-F117 VanDerWaalsContact CE1-CB 3.49Å; F106-F117 HydrophobicContact CE1-CD2 4.47Å; F106-F117 HydrophobicContact CE1-CG 4.18Å; F106-F117 HydrophobicContact CE2-CB 4.18Å; F106-F117 AromaticContact CE2-CD2 3.62Å; F106-F117 HydrophobicContact CE2-CD2 3.62Å; F106-F117 HydrophobicContact CE2-CE2 4.36Å; F106-F117 HydrophobicContact CE2-CG 4.11Å; F106-F117 HydrophobicContact CG-CB 4.4Å; F106-F117 HydrophobicContact CZ-CB 3.65Å; F106-F117 AromaticContact CZ-CD2 3.8Å; F106-F117 HydrophobicContact CZ-CD2 3.8Å; F106-F117 AromaticContact CZ-CG 3.79Å; F106-F117 HydrophobicContact CZ-CG 3.79Å; F106-F117 PolarHBondContact N-O 2.69Å; F106-F117 PolarHBondContact O-N 3.26Å; F106-R125 HydrophobicContact CB-CG 4.13Å; F106-R125 HydrophobicContact CD1-CG 3.99Å; F106-R125 HydrophobicContact CG-CG 4.49Å; F106-W128 HydrophobicContact CE1-CB 3.91Å; F106-W128 HydrophobicContact CE1-CD2 4.38Å; F106-W128 AromaticContact CE1-CE3 3.68Å; F106-W128 HydrophobicContact CE1-CE3 3.68Å; F106-W128 HydrophobicContact CZ-CB 4Å; F106-W128 AromaticContact CZ-CE3 3.86Å; F106-W128 HydrophobicContact CZ-CE3 3.86Å; F106-I129 HydrophobicContact CB-CD1 3.76Å; F106-I129 HydrophobicContact CB-CG1 3.79Å; F106-I129 HydrophobicContact CD1-CG1 4.37Å; F106-I129 HydrophobicContact CD2-CG1 4.03Å; F106-I129 HydrophobicContact CG-CD1 4.33Å; F106-I129 HydrophobicContact CG-CG1 3.84Å; F106-L132 HydrophobicContact CE2-CD1 3.53Å; F106-L132 HydrophobicContact CZ-CD1 3.85Å
107	E	86.2	Confident	80.3	Confident	21 Å²	21	38.8 Å²	38.8	10%	0.098	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	149.6	174.5	67.5	179.7	-114.9	0	0	111.3	I92 K93 V95 T114 K115	I92-E107 WeakPolarHBondContact CA-O 3.27Å; K93-E107 HydrophobicContact CD-CG 4.36Å; K93-E107 WeakPolarHBondContact CE-OE1 3.37Å; K93-E107 HydrophobicContact CG-CG 3.63Å; K93-E107 PolarHBondContact N-O 2.95Å; K93-E107 IonicContact NZ-OE1 3.39Å; K93-E107 PolarHBondContact O-N 3.21Å; V95-E107 HydrophobicContact CG2-CB 3.73Å; V95-E107 HydrophobicContact CG2-CG 3.76Å; V95-E107 WeakPolarHBondContact CG2-OE2 3.45Å; E107-T114 HydrophobicContact CB-CG2 4Å; E107-T114 HydrophobicContact CG-CG2 4.43Å; E107-K115 WeakPolarHBondContact CA-O 3.36Å
108	V	85.9	Confident	80.6	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	111.3	171.1	-174.4	0	0	0	0	106.6	L82 L84 I91 I92 F106 T110 T114 K115 F117 L132	L82-V108 HydrophobicContact CD1-CG2 4.28Å; L84-V108 HydrophobicContact CD2-CG1 4.03Å; I91-V108 WeakPolarHBondContact O-CA 3.42Å; I92-V108 HydrophobicContact CG1-CG1 3.96Å; I92-V108 HydrophobicContact CG1-CG2 4.19Å; I92-V108 HydrophobicContact CG2-CG2 4.36Å; F106-V108 HydrophobicContact CD2-CG2 4.04Å; F106-V108 HydrophobicContact CE2-CG2 3.63Å; V108-T110 HydrophobicContact CG1-CG2 4.07Å; V108-T114 WeakPolarHBondContact O-CA 3.32Å; V108-K115 PolarHBondContact N-O 2.86Å; V108-K115 PolarHBondContact O-N 2.98Å; V108-F117 HydrophobicContact CB-CE2 4.12Å; V108-F117 HydrophobicContact CG2-CD2 4.12Å; V108-F117 HydrophobicContact CG2-CE2 3.73Å; V108-L132 HydrophobicContact CG2-CD1 4.08Å
109	T	84.1	Confident	80.8	Confident	30 Å²	30	38.2 Å²	38.2	18%	0.184	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130	170.4	-63.9	0	0	0	0	109	A90 I91 T114	A90-T109 CarbonylContact C-O 3.49Å; A90-T109 VanDerWaalsContact CA-O 3.28Å; A90-T109 WeakPolarHBondContact CA-O 3.4Å; I91-T109 PolarHBondContact N-O 2.66Å; I91-T109 PolarHBondContact O-N 2.89Å; T109-T114 WeakPolarHBondContact OG1-CB 3.49Å; T109-T114 VanDerWaalsContact OG1-CG2 3.25Å; T109-T114 WeakPolarHBondContact OG1-CG2 2.89Å; T109-T114 PolarHBondContact OG1-OG1 2.84Å
110	T	82.9	Confident	80.8	Confident	14 Å²	14	45.4 Å²	45.4	9%	0.086	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	172	177.8	56.9	0	0	0	0	109.2	L84 D87 A90 V108 S112 G113	L84-T110 HydrophobicContact CD2-CG2 3.6Å; D87-T110 WeakPolarHBondContact OD2-CA 3.44Å; D87-T110 WeakPolarHBondContact OD2-CB 3.44Å; A90-T110 HydrophobicContact CB-CG2 4.3Å; V108-T110 HydrophobicContact CG1-CG2 4.07Å; T110-S112 PolarHBondContact O-N 2.93Å; T110-S112 VanDerWaalsContact O-N 3.15Å; T110-S112 PolarHBondContact OG1-N 2.81Å; T110-S112 PolarHBondContact OG1-OG 3.45Å; T110-G113 PolarHBondContact N-O 3.34Å; T110-G113 WeakPolarHBondContact O-CA 3.16Å; T110-G113 PolarHBondContact O-N 3.07Å; T110-G113 PolarHBondContact OG1-N 3.28Å; T110-G113 PolarHBondContact OG1-O 3.42Å
111	A	77.1	Confident	80.8	Confident	100 Å²	100	46.3 Å²	46.3	83%	0.826	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-26.6	166.2	0	0	0	0	0	112.9	D87 G113	D87-A111 PolarHBondContact OD2-N 2.71Å; A111-G113 VanDerWaalsContact C-N 3.25Å; A111-G113 PolarHBondContact O-N 2.88Å
112	S	76.6	Confident	81	Confident	86 Å²	86	44.5 Å²	44.5	60%	0.601	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.3	172.8	80.2	0	0	0	0	114.5	T110 K115	T110-S112 PolarHBondContact O-N 2.93Å; T110-S112 VanDerWaalsContact O-N 3.15Å; T110-S112 PolarHBondContact OG1-N 2.81Å; T110-S112 PolarHBondContact OG1-OG 3.45Å; S112-K115 PolarHBondContact OG-NZ 3.12Å
113	G	77.3	Confident	81	Confident	33 Å²	33	42.5 Å²	42.5	34%	0.34	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	112	-178	-176.2	0	0	0	0	0	114	T110 A111	T110-G113 PolarHBondContact N-O 3.34Å; T110-G113 WeakPolarHBondContact O-CA 3.16Å; T110-G113 PolarHBondContact O-N 3.07Å; T110-G113 PolarHBondContact OG1-N 3.28Å; T110-G113 PolarHBondContact OG1-O 3.42Å; A111-G113 VanDerWaalsContact C-N 3.25Å; A111-G113 PolarHBondContact O-N 2.88Å
114	T	80.8	Confident	81.2	Confident	52 Å²	52	40.8 Å²	40.8	32%	0.319	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	131	-180	-49.3	0	0	0	0	112.2	L59 E107 V108 T109	L59-T114 HydrophobicContact CD1-CG2 3.84Å; E107-T114 HydrophobicContact CB-CG2 4Å; E107-T114 HydrophobicContact CG-CG2 4.43Å; V108-T114 WeakPolarHBondContact O-CA 3.32Å; T109-T114 WeakPolarHBondContact OG1-CB 3.49Å; T109-T114 VanDerWaalsContact OG1-CG2 3.25Å; T109-T114 WeakPolarHBondContact OG1-CG2 2.89Å; T109-T114 PolarHBondContact OG1-OG1 2.84Å
115	K	81.7	Confident	81.3	Confident	60 Å²	60	41.5 Å²	41.5	26%	0.261	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129	175.6	-60.5	161	-168.5	159.9	0	108.4	L82 E107 V108 S112 F117	L82-K115 HydrophobicContact CD2-CD 4.47Å; L82-K115 PolarHBondContact O-NZ 2.9Å; E107-K115 WeakPolarHBondContact CA-O 3.36Å; V108-K115 PolarHBondContact N-O 2.86Å; V108-K115 PolarHBondContact O-N 2.98Å; S112-K115 PolarHBondContact OG-NZ 3.12Å; K115-F117 HydrophobicContact CB-CE2 3.7Å; K115-F117 HydrophobicContact CB-CZ 3.83Å
116	C	83.9	Confident	81.1	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.034	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	142.1	174.3	-68.6	0	0	0	0	111.4	F63 F106	F63-C116 HydrophobicContact CE1-CB 3.96Å; F63-C116 HydrophobicContact CE2-CB 4.18Å; F63-C116 HydrophobicContact CZ-CB 3.59Å; F106-C116 WeakPolarHBondContact O-CA 3.5Å
117	F	83.8	Confident	80.8	Confident	24 Å²	24	50 Å²	50	11%	0.105	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.1	179.8	-57.4	-88.3	0	0	0	109.9	L82 C105 F106 V108 K115	L82-F117 HydrophobicContact CD1-CE2 4.43Å; L82-F117 HydrophobicContact CD1-CZ 4.15Å; L82-F117 HydrophobicContact CD2-CE1 4.21Å; L82-F117 HydrophobicContact CD2-CZ 3.63Å; C105-F117 CarbonylContact C-O 3.53Å; C105-F117 WeakPolarHBondContact CA-O 3.35Å; C105-F117 WeakPolarHBondContact CB-O 3.33Å; F106-F117 HydrophobicContact CD1-CB 3.89Å; F106-F117 HydrophobicContact CD2-CD2 4.16Å; F106-F117 HydrophobicContact CE1-CB 3.49Å; F106-F117 VanDerWaalsContact CE1-CB 3.49Å; F106-F117 HydrophobicContact CE1-CD2 4.47Å; F106-F117 HydrophobicContact CE1-CG 4.18Å; F106-F117 HydrophobicContact CE2-CB 4.18Å; F106-F117 AromaticContact CE2-CD2 3.62Å; F106-F117 HydrophobicContact CE2-CD2 3.62Å; F106-F117 HydrophobicContact CE2-CE2 4.36Å; F106-F117 HydrophobicContact CE2-CG 4.11Å; F106-F117 HydrophobicContact CG-CB 4.4Å; F106-F117 HydrophobicContact CZ-CB 3.65Å; F106-F117 AromaticContact CZ-CD2 3.8Å; F106-F117 HydrophobicContact CZ-CD2 3.8Å; F106-F117 AromaticContact CZ-CG 3.79Å; F106-F117 HydrophobicContact CZ-CG 3.79Å; F106-F117 PolarHBondContact N-O 2.69Å; F106-F117 PolarHBondContact O-N 3.26Å; V108-F117 HydrophobicContact CB-CE2 4.12Å; V108-F117 HydrophobicContact CG2-CD2 4.12Å; V108-F117 HydrophobicContact CG2-CE2 3.73Å; K115-F117 HydrophobicContact CB-CE2 3.7Å; K115-F117 HydrophobicContact CB-CZ 3.83Å
118	A	83.2	Confident	80.6	Confident	35 Å²	35	49.4 Å²	49.4	29%	0.289	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.3	177.8	0	0	0	0	0	110.2	Q102	Q102-A118 HydrophobicContact CG-CB 4.47Å
119	C	83.4	Confident	80.5	Confident	14 Å²	14	50 Å²	50	10%	0.095	29%	0.292	C	S	.	.			trans	-104	166.2	-178.3	-59.7	0	0	0	0	111.7	Y104 E124 R125	Y104-C119 WeakPolarHBondContact O-CB 3.46Å; Y104-C119 PolarHBondContact O-N 2.85Å; C119-E124 HydrophobicContact CB-CB 4.09Å; C119-E124 HydrophobicContact CB-CG 4.03Å; C119-E124 WeakPolarHBondContact CB-OE2 3.49Å; C119-R125 HydrophobicContact CB-CB 3.98Å; C119-R125 VanDerWaalsContact SG-CA 3.54Å
120	R	79.1	Confident	80.2	Confident	170 Å²	170	49.6 Å²	49.6	64%	0.642	29%	0.288	S	S	*	.	S	Bend	trans	-77.2	-27.1	177.4	-53.7	177.8	-172.8	-151.1	2.9	112.3	E124	R120-E124 VanDerWaalsContact CB-OE2 3.28Å; R120-E124 WeakPolarHBondContact CB-OE2 3.34Å; R120-E124 WeakPolarHBondContact CG-OE2 3.5Å; R120-E124 PolarHBondContact N-OE2 3.43Å
121	S	75.1	Confident	80.2	Confident	49 Å²	49	49.3 Å²	49.3	34%	0.343	29%	0.286	S	S	.	.	S	Bend	trans	-147.8	164.2	-179	76	0	0	0	0	112.2	Y104 E124 R125	Y104-S121 WeakPolarHBondContact CB-O 3.45Å; S121-E124 PolarHBondContact O-N 2.86Å; S121-E124 PolarHBondContact OG-N 3.35Å; S121-E124 VanDerWaalsContact OG-N 3.15Å; S121-R125 PolarHBondContact O-N 2.9Å; S121-R125 VanDerWaalsContact O-N 3.1Å
122	A	75.4	Confident	80.5	Confident	31 Å²	31	44.5 Å²	44.5	26%	0.256	25%	0.246	S	C	.	.	H	α-helix	trans	-60.8	-45.1	174.7	0	0	0	0	0	111.6	Y104 E124 R125 D126	Y104-A122 VanDerWaalsContact CD1-CA 3.46Å; Y104-A122 HydrophobicContact CD1-CB 3.67Å; Y104-A122 HydrophobicContact CE1-CB 3.89Å; A122-E124 VanDerWaalsContact C-N 3.32Å; A122-E124 PolarHBondContact O-N 2.91Å; A122-R125 WeakPolarHBondContact O-CB 3.41Å; A122-R125 PolarHBondContact O-N 2.83Å; A122-R125 VanDerWaalsContact O-N 3.16Å; A122-D126 WeakPolarHBondContact O-CB 3.37Å; A122-D126 VanDerWaalsContact O-CG 3.26Å; A122-D126 PolarHBondContact O-N 3.36Å
123	A	73.8	Confident	80.7	Confident	46 Å²	46	42.2 Å²	42.2	38%	0.38	23%	0.226	S	C	.	.	H	α-helix	trans	-61.1	-37.8	178.5	0	0	0	0	0	112.7	K127	A123-K127 WeakPolarHBondContact O-CB 3.48Å; A123-K127 PolarHBondContact O-N 3.04Å
124	E	81	Confident	80.8	Confident	48 Å²	48	44.7 Å²	44.7	22%	0.224	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-47.5	173.4	-175	-178.8	-142.1	0	0	111.2	C119 R120 S121 A122 D126 K127 W128	C119-E124 HydrophobicContact CB-CB 4.09Å; C119-E124 HydrophobicContact CB-CG 4.03Å; C119-E124 WeakPolarHBondContact CB-OE2 3.49Å; R120-E124 VanDerWaalsContact CB-OE2 3.28Å; R120-E124 WeakPolarHBondContact CB-OE2 3.34Å; R120-E124 WeakPolarHBondContact CG-OE2 3.5Å; R120-E124 PolarHBondContact N-OE2 3.43Å; S121-E124 PolarHBondContact O-N 2.86Å; S121-E124 PolarHBondContact OG-N 3.35Å; S121-E124 VanDerWaalsContact OG-N 3.15Å; A122-E124 VanDerWaalsContact C-N 3.32Å; A122-E124 PolarHBondContact O-N 2.91Å; E124-D126 PolarHBondContact O-N 2.85Å; E124-K127 PolarHBondContact O-N 2.81Å; E124-W128 HydrophobicContact CG-CZ2 4.15Å; E124-W128 WeakPolarHBondContact O-CB 3.18Å; E124-W128 PolarHBondContact O-N 3.41Å
125	R	84.1	Confident	80.7	Confident	52 Å²	52	43.2 Å²	43.2	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-55.7	-51.1	175.6	-179.3	-154.9	61.8	-158.7	-4.7	111.6	C105 F106 C119 S121 A122 W128 I129	C105-R125 VanDerWaalsContact O-CD 3.25Å; C105-R125 WeakPolarHBondContact O-CD 3.41Å; F106-R125 HydrophobicContact CB-CG 4.13Å; F106-R125 HydrophobicContact CD1-CG 3.99Å; F106-R125 HydrophobicContact CG-CG 4.49Å; C119-R125 HydrophobicContact CB-CB 3.98Å; C119-R125 VanDerWaalsContact SG-CA 3.54Å; S121-R125 PolarHBondContact O-N 2.9Å; S121-R125 VanDerWaalsContact O-N 3.1Å; A122-R125 WeakPolarHBondContact O-CB 3.41Å; A122-R125 PolarHBondContact O-N 2.83Å; A122-R125 VanDerWaalsContact O-N 3.16Å; R125-W128 PolarHBondContact O-N 3.42Å; R125-I129 HydrophobicContact CG-CD1 3.82Å; R125-I129 HydrophobicContact CG-CG1 4.46Å; R125-I129 WeakPolarHBondContact O-CG1 3.41Å; R125-I129 PolarHBondContact O-N 2.88Å
126	D	81.4	Confident	80.6	Confident	66 Å²	66	41 Å²	41	35%	0.353	21%	0.209	S	C	.	.	H	α-helix	trans	-69.7	-37.8	-172.8	-64.5	-36.8	0	0	0	111	A122 E124 I129 E130	A122-D126 WeakPolarHBondContact O-CB 3.37Å; A122-D126 VanDerWaalsContact O-CG 3.26Å; A122-D126 PolarHBondContact O-N 3.36Å; E124-D126 PolarHBondContact O-N 2.85Å; D126-I129 PolarHBondContact O-N 3.17Å; D126-E130 VanDerWaalsContact O-CB 3.31Å; D126-E130 WeakPolarHBondContact O-CB 3.48Å; D126-E130 PolarHBondContact O-N 3.39Å
127	K	79.8	Confident	80.2	Confident	113 Å²	113	45.1 Å²	45.1	49%	0.491	23%	0.227	S	C	.	.	H	α-helix	trans	-63.5	-39.1	170.7	-174.1	171.3	-175.9	170.8	0	112.9	L73 A123 E124 N131	L73-K127 HydrophobicContact CD2-CD 4.41Å; A123-K127 WeakPolarHBondContact O-CB 3.48Å; A123-K127 PolarHBondContact O-N 3.04Å; E124-K127 PolarHBondContact O-N 2.81Å; K127-N131 VanDerWaalsContact O-CB 3.26Å; K127-N131 WeakPolarHBondContact O-CB 3.45Å; K127-N131 VanDerWaalsContact O-CG 3.26Å; K127-N131 PolarHBondContact O-N 2.85Å
128	W	83.2	Confident	79.7	Confident	9 Å²	9	48.8 Å²	48.8	3%	0.034	25%	0.253	C	S	.	.	H	α-helix	trans	-68.3	-46.3	175.9	-72.8	26.9	0	0	0	111.1	H69 L72 F106 E124 R125 E130 N131 L132	H69-W128 HydrophobicContact CB-CH2 4.01Å; H69-W128 HydrophobicContact CB-CZ3 4.37Å; L72-W128 HydrophobicContact CB-CD2 4.02Å; L72-W128 HydrophobicContact CB-CE3 4.11Å; L72-W128 HydrophobicContact CB-CG 4.38Å; L72-W128 HydrophobicContact CD1-CD2 4.25Å; L72-W128 HydrophobicContact CD1-CE3 3.48Å; L72-W128 VanDerWaalsContact CD1-CE3 3.48Å; L72-W128 HydrophobicContact CD1-CH2 4.34Å; L72-W128 HydrophobicContact CD1-CZ3 3.54Å; L72-W128 HydrophobicContact CG-CE3 4.43Å; F106-W128 HydrophobicContact CE1-CB 3.91Å; F106-W128 HydrophobicContact CE1-CD2 4.38Å; F106-W128 AromaticContact CE1-CE3 3.68Å; F106-W128 HydrophobicContact CE1-CE3 3.68Å; F106-W128 HydrophobicContact CZ-CB 4Å; F106-W128 AromaticContact CZ-CE3 3.86Å; F106-W128 HydrophobicContact CZ-CE3 3.86Å; E124-W128 HydrophobicContact CG-CZ2 4.15Å; E124-W128 WeakPolarHBondContact O-CB 3.18Å; E124-W128 PolarHBondContact O-N 3.41Å; R125-W128 PolarHBondContact O-N 3.42Å; W128-E130 VanDerWaalsContact C-N 3.32Å; W128-E130 PolarHBondContact O-N 3.47Å; W128-N131 PolarHBondContact O-N 2.98Å; W128-L132 WeakPolarHBondContact O-CB 3.33Å; W128-L132 WeakPolarHBondContact O-CD1 3.21Å; W128-L132 WeakPolarHBondContact O-CG 3.43Å; W128-L132 PolarHBondContact O-N 3.23Å
129	I	82.8	Confident	79.3	Confident	14 Å²	14	52.4 Å²	52.4	7%	0.072	27%	0.268	C	S	.	.	H	α-helix	trans	-54.3	-49.3	173.4	-72.2	167.9	0	0	0	110.4	I92 P94 F106 R125 D126 L132 Q133	I92-I129 HydrophobicContact CG2-CB 4.38Å; I92-I129 HydrophobicContact CG2-CG1 4.34Å; I92-I129 HydrophobicContact CG2-CG2 4.13Å; P94-I129 HydrophobicContact CB-CD1 3.8Å; P94-I129 HydrophobicContact CG-CD1 4.41Å; F106-I129 HydrophobicContact CB-CD1 3.76Å; F106-I129 HydrophobicContact CB-CG1 3.79Å; F106-I129 HydrophobicContact CD1-CG1 4.37Å; F106-I129 HydrophobicContact CD2-CG1 4.03Å; F106-I129 HydrophobicContact CG-CD1 4.33Å; F106-I129 HydrophobicContact CG-CG1 3.84Å; R125-I129 HydrophobicContact CG-CD1 3.82Å; R125-I129 HydrophobicContact CG-CG1 4.46Å; R125-I129 WeakPolarHBondContact O-CG1 3.41Å; R125-I129 PolarHBondContact O-N 2.88Å; D126-I129 PolarHBondContact O-N 3.17Å; I129-L132 PolarHBondContact O-N 3.45Å; I129-Q133 HydrophobicContact CG2-CG 4.47Å; I129-Q133 WeakPolarHBondContact O-CG 3.25Å; I129-Q133 PolarHBondContact O-N 2.88Å
130	E	78.4	Confident	79	Confident	20 Å²	20	53.1 Å²	53.1	9%	0.093	27%	0.269	C	S	.	.	H	α-helix	trans	-69.4	-42.7	-175.4	-157.9	-137.1	147.7	0	0	112.1	D126 W128 L132 Q133 R134 Y552	D126-E130 VanDerWaalsContact O-CB 3.31Å; D126-E130 WeakPolarHBondContact O-CB 3.48Å; D126-E130 PolarHBondContact O-N 3.39Å; W128-E130 VanDerWaalsContact C-N 3.32Å; W128-E130 PolarHBondContact O-N 3.47Å; E130-L132 VanDerWaalsContact C-N 3.3Å; E130-L132 PolarHBondContact O-N 3.09Å; E130-Q133 PolarHBondContact O-N 2.74Å; E130-R134 WeakPolarHBondContact O-CG 3.27Å; E130-R134 PolarHBondContact O-N 3.36Å; E130-R134 IonicContact OE1-CZ 3.89Å; E130-R134 IonicContact OE1-NE 2.86Å; E130-R134 PolarHBondContact OE1-NE 3.18Å; E130-R134 IonicContact OE1-NH2 2.99Å; E130-R134 PolarHBondContact OE1-NH2 3.21Å; E130-R134 IonicContact OE2-CZ 3.74Å; E130-R134 IonicContact OE2-NH2 3.99Å; E130-R134 PolarHBondContact OE2-NH2 2.88Å; E130-Y552 HydrophobicContact CG-CD1 3.8Å; E130-Y552 HydrophobicContact CG-CD2 4.46Å; E130-Y552 HydrophobicContact CG-CE1 3.95Å; E130-Y552 HydrophobicContact CG-CG 4.06Å; E130-Y552 WeakPolarHBondContact OE1-CD2 3.48Å; E130-Y552 WeakPolarHBondContact OE1-CE2 3.25Å; E130-Y552 WeakPolarHBondContact OE2-CB 3.41Å; E130-Y552 WeakPolarHBondContact OE2-CD2 3.26Å
131	N	82.1	Confident	79	Confident	8 Å²	8	47.6 Å²	47.6	4%	0.043	25%	0.252	C	S	.	.	H	α-helix	trans	-57.8	-42.5	172.8	-83	-12.7	0	0	0	112.2	L72 L73 K127 W128 R134 A135	L72-N131 PolarHBondContact O-ND2 3.19Å; L73-N131 VanDerWaalsContact CA-ND2 3.33Å; L73-N131 WeakPolarHBondContact CA-ND2 3.38Å; L73-N131 PolarHBondContact O-ND2 3.11Å; K127-N131 VanDerWaalsContact O-CB 3.26Å; K127-N131 WeakPolarHBondContact O-CB 3.45Å; K127-N131 VanDerWaalsContact O-CG 3.26Å; K127-N131 PolarHBondContact O-N 2.85Å; W128-N131 PolarHBondContact O-N 2.98Å; N131-R134 PolarHBondContact O-N 3.42Å; N131-R134 PolarHBondContact OD1-NH1 3.02Å; N131-A135 WeakPolarHBondContact O-CB 3.48Å; N131-A135 PolarHBondContact O-N 3.44Å
132	L	83	Confident	79.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.9	-40.5	176.8	-71.7	168.5	0	0	0	111.8	L72 A78 L82 L84 I92 F106 V108 W128 I129 E130 A135 V136	L72-L132 HydrophobicContact CD2-CD2 4.25Å; A78-L132 HydrophobicContact CB-CD2 3.72Å; L82-L132 HydrophobicContact CD1-CD1 4.2Å; L82-L132 HydrophobicContact CD1-CD2 3.7Å; L84-L132 HydrophobicContact CD1-CD2 3.59Å; I92-L132 HydrophobicContact CD1-CB 3.68Å; I92-L132 HydrophobicContact CG1-CB 4.24Å; I92-L132 HydrophobicContact CG2-CB 4.19Å; I92-L132 HydrophobicContact CG2-CD1 4.46Å; F106-L132 HydrophobicContact CE2-CD1 3.53Å; F106-L132 HydrophobicContact CZ-CD1 3.85Å; V108-L132 HydrophobicContact CG2-CD1 4.08Å; W128-L132 WeakPolarHBondContact O-CB 3.33Å; W128-L132 WeakPolarHBondContact O-CD1 3.21Å; W128-L132 WeakPolarHBondContact O-CG 3.43Å; W128-L132 PolarHBondContact O-N 3.23Å; I129-L132 PolarHBondContact O-N 3.45Å; E130-L132 VanDerWaalsContact C-N 3.3Å; E130-L132 PolarHBondContact O-N 3.09Å; L132-A135 WeakPolarHBondContact O-CB 3.44Å; L132-A135 PolarHBondContact O-N 2.94Å; L132-A135 VanDerWaalsContact O-N 3.17Å; L132-V136 WeakPolarHBondContact O-CG2 3.5Å; L132-V136 PolarHBondContact O-N 2.93Å
133	Q	81.3	Confident	79.8	Confident	38 Å²	38	51.3 Å²	51.3	18%	0.178	27%	0.267	C	S	.	.	H	α-helix	trans	-65	-38	174.6	-74.8	-176.1	8.8	0	0	112.1	I92 I129 E130 A135 K137	I92-Q133 HydrophobicContact CB-CG 4.27Å; I92-Q133 HydrophobicContact CD1-CG 4.18Å; I92-Q133 HydrophobicContact CG2-CG 4.49Å; I92-Q133 PolarHBondContact O-NE2 3.4Å; I129-Q133 HydrophobicContact CG2-CG 4.47Å; I129-Q133 WeakPolarHBondContact O-CG 3.25Å; I129-Q133 PolarHBondContact O-N 2.88Å; E130-Q133 PolarHBondContact O-N 2.74Å; Q133-A135 VanDerWaalsContact C-N 3.33Å; Q133-K137 PolarHBondContact O-N 2.99Å
134	R	78.7	Confident	80.5	Confident	85 Å²	85	52.8 Å²	52.8	32%	0.321	26%	0.263	S	S	.	.	H	α-helix	trans	-68.8	-30	171.6	-71.5	-162.2	-113.2	95.1	-8.9	112.7	E130 N131 K137 P138	E130-R134 WeakPolarHBondContact O-CG 3.27Å; E130-R134 PolarHBondContact O-N 3.36Å; E130-R134 IonicContact OE1-CZ 3.89Å; E130-R134 IonicContact OE1-NE 2.86Å; E130-R134 PolarHBondContact OE1-NE 3.18Å; E130-R134 IonicContact OE1-NH2 2.99Å; E130-R134 PolarHBondContact OE1-NH2 3.21Å; E130-R134 IonicContact OE2-CZ 3.74Å; E130-R134 IonicContact OE2-NH2 3.99Å; E130-R134 PolarHBondContact OE2-NH2 2.88Å; N131-R134 PolarHBondContact O-N 3.42Å; N131-R134 PolarHBondContact OD1-NH1 3.02Å; R134-K137 CarbonylContact O-C 3.55Å; R134-P138 WeakPolarHBondContact O-CA 3.4Å; R134-P138 VanDerWaalsContact O-N 3.13Å
135	A	80.1	Confident	80.8	Confident	21 Å²	21	51.7 Å²	51.7	17%	0.174	26%	0.257	C	S	.	.	H	α-helix	trans	-69.9	-44.6	175.6	0	0	0	0	0	112.3	P75 A79 N131 L132 Q133	P75-A135 HydrophobicContact CB-CB 4.16Å; P75-A135 WeakPolarHBondContact O-CB 3.31Å; A79-A135 HydrophobicContact CB-CB 4.16Å; N131-A135 WeakPolarHBondContact O-CB 3.48Å; N131-A135 PolarHBondContact O-N 3.44Å; L132-A135 WeakPolarHBondContact O-CB 3.44Å; L132-A135 PolarHBondContact O-N 2.94Å; L132-A135 VanDerWaalsContact O-N 3.17Å; Q133-A135 VanDerWaalsContact C-N 3.33Å
136	V	78.3	Confident	81	Confident	12 Å²	12	52.9 Å²	52.9	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-70.7	-41.1	175.4	-178.4	0	0	0	0	110.9	L84 A90 I92 L132 P138	L84-V136 HydrophobicContact CB-CG2 4.1Å; L84-V136 HydrophobicContact CD1-CG2 4.2Å; L84-V136 HydrophobicContact CD2-CG2 4.23Å; L84-V136 HydrophobicContact CG-CG2 4.42Å; A90-V136 HydrophobicContact CB-CG1 4.38Å; A90-V136 HydrophobicContact CB-CG2 4.12Å; I92-V136 HydrophobicContact CD1-CG2 3.75Å; L132-V136 WeakPolarHBondContact O-CG2 3.5Å; L132-V136 PolarHBondContact O-N 2.93Å; V136-P138 WeakPolarHBondContact O-CD 3.45Å
137	K	75.9	Confident	81.3	Confident	93 Å²	93	49.9 Å²	49.9	40%	0.404	25%	0.254	S	S	.	.			trans	-129.2	72.4	-173.6	-53.8	-167.4	-172.2	-93.7	0	111.2	E88 Q133 R134 N139 K140	E88-K137 WeakPolarHBondContact O-CE 3.14Å; E88-K137 PolarHBondContact O-NZ 2.73Å; E88-K137 IonicContact OE2-NZ 3.77Å; E88-K137 PolarHBondContact OE2-NZ 2.9Å; Q133-K137 PolarHBondContact O-N 2.99Å; R134-K137 CarbonylContact O-C 3.55Å; K137-N139 PolarHBondContact O-N 3.31Å; K137-K140 HydrophobicContact CB-CB 4.48Å; K137-K140 VanDerWaalsContact O-CB 3.27Å; K137-K140 WeakPolarHBondContact O-CB 3.32Å; K137-K140 PolarHBondContact O-N 3.2Å
138	P	74.6	Confident	81.9	Confident	100 Å²	100	45 Å²	45	65%	0.649	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.6	-176	23.5	-34.3	0	0	0	113.5	R134 V136 K140	R134-P138 WeakPolarHBondContact O-CA 3.4Å; R134-P138 VanDerWaalsContact O-N 3.13Å; V136-P138 WeakPolarHBondContact O-CD 3.45Å; P138-K140 VanDerWaalsContact C-N 3.32Å; P138-K140 PolarHBondContact O-N 3.04Å
139	N	73.6	Confident	82.2	Confident	112 Å²	112	44.9 Å²	44.9	60%	0.599	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	15.1	176.4	-73.6	-41.7	0	0	0	114	K137 D141 N142 S143	K137-N139 PolarHBondContact O-N 3.31Å; N139-D141 PolarHBondContact O-N 2.9Å; N139-D141 VanDerWaalsContact O-N 3.11Å; N139-N142 CarbonylContact O-C 3.6Å; N139-N142 PolarHBondContact O-N 2.89Å; N139-S143 WeakPolarHBondContact O-CB 3.47Å; N139-S143 PolarHBondContact O-N 3.19Å; N139-S143 VanDerWaalsContact O-N 3.09Å; N139-S143 PolarHBondContact O-OG 2.95Å
140	K	77.4	Confident	82.7	Confident	29 Å²	29	44.2 Å²	44.2	13%	0.126	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-46.3	-45.9	-176.6	-174.5	-176	177.4	-173.4	0	112.3	K137 P138 S143 R145	K137-K140 HydrophobicContact CB-CB 4.48Å; K137-K140 VanDerWaalsContact O-CB 3.27Å; K137-K140 WeakPolarHBondContact O-CB 3.32Å; K137-K140 PolarHBondContact O-N 3.2Å; P138-K140 VanDerWaalsContact C-N 3.32Å; P138-K140 PolarHBondContact O-N 3.04Å; K140-S143 PolarHBondContact O-N 3Å; K140-S143 PolarHBondContact O-OG 3.44Å; K140-R145 PolarHBondContact O-NH1 3.28Å
141	D	78.9	Confident	83.4	Confident	54 Å²	54	46.1 Å²	46.1	29%	0.289	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-80.5	-16.7	-178.1	-64.3	-46.3	0	0	0	115.5	N139 R145 M284	N139-D141 PolarHBondContact O-N 2.9Å; N139-D141 VanDerWaalsContact O-N 3.11Å; D141-R145 VanDerWaalsContact CA-NH1 3.35Å; D141-R145 IonicContact OD1-CZ 3.8Å; D141-R145 VanDerWaalsContact OD1-CZ 3.23Å; D141-R145 IonicContact OD1-NH1 2.76Å; D141-R145 PolarHBondContact OD1-NH1 2.91Å; D141-R145 IonicContact OD1-NH2 2.77Å; D141-R145 PolarHBondContact OD1-NH2 3.35Å; D141-M284 PolarHBondContact O-N 3.06Å
142	N	82.6	Confident	84	Confident	111 Å²	111	45.8 Å²	45.8	59%	0.594	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-96.6	4.6	172.8	-62.9	-29.4	0	0	0	112	N139 P283	N139-N142 CarbonylContact O-C 3.6Å; N139-N142 PolarHBondContact O-N 2.89Å; N142-P283 WeakPolarHBondContact O-CG 3.19Å
143	S	85	Confident	84.5	Confident	46 Å²	46	48 Å²	48	32%	0.322	25%	0.245	S	C	.	.	S	Bend	trans	-115.2	147.1	-177.2	75.8	0	0	0	0	111.6	N139 K140 R145	N139-S143 WeakPolarHBondContact O-CB 3.47Å; N139-S143 PolarHBondContact O-N 3.19Å; N139-S143 VanDerWaalsContact O-N 3.09Å; N139-S143 PolarHBondContact O-OG 2.95Å; K140-S143 PolarHBondContact O-N 3Å; K140-S143 PolarHBondContact O-OG 3.44Å; S143-R145 PolarHBondContact O-N 2.9Å
144	R	88.4	Confident	85.1	Confident	77 Å²	77	46.2 Å²	46.2	29%	0.291	24%	0.236	S	C	.	.			trans	-70.8	113.7	167.8	-177.8	179.2	179.1	129	-0.1	108.1	I281 A594 L595	R144-I281 CarbonylContact C-O 3.6Å; R144-I281 WeakPolarHBondContact CA-O 3.27Å; R144-A594 PolarHBondContact NH1-O 3.38Å; R144-L595 PolarHBondContact NH2-O 3.27Å
145	R	87.3	Confident	85.8	Confident	26 Å²	26	43.3 Å²	43.3	10%	0.098	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	165.1	-178.5	69	174.8	172.4	-103.8	17.5	112.2	K140 D141 S143 I281 D554	K140-R145 PolarHBondContact O-NH1 3.28Å; D141-R145 VanDerWaalsContact CA-NH1 3.35Å; D141-R145 IonicContact OD1-CZ 3.8Å; D141-R145 VanDerWaalsContact OD1-CZ 3.23Å; D141-R145 IonicContact OD1-NH1 2.76Å; D141-R145 PolarHBondContact OD1-NH1 2.91Å; D141-R145 IonicContact OD1-NH2 2.77Å; D141-R145 PolarHBondContact OD1-NH2 3.35Å; S143-R145 PolarHBondContact O-N 2.9Å; R145-I281 HydrophobicContact CG-CB 3.76Å; R145-I281 HydrophobicContact CG-CD1 4.18Å; R145-I281 HydrophobicContact CG-CG2 4.12Å; R145-I281 PolarHBondContact N-O 3.15Å; R145-I281 PolarHBondContact O-N 3.45Å; R145-D554 IonicContact CZ-OD1 3.56Å; R145-D554 IonicContact CZ-OD2 3.06Å; R145-D554 IonicContact NE-OD2 2.97Å; R145-D554 IonicContact NH2-OD1 2.74Å; R145-D554 PolarHBondContact NH2-OD1 3.04Å; R145-D554 IonicContact NH2-OD2 2.81Å; R145-D554 PolarHBondContact NH2-OD2 3.06Å
146	V	88.5	Confident	86.5	Confident	77 Å²	77	43.5 Å²	43.5	47%	0.467	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.1	172.3	-178.7	0	0	0	0	108	T278 M279	V146-T278 HydrophobicContact CG1-CG2 3.49Å; V146-T278 VanDerWaalsContact CG1-CG2 3.49Å; V146-M279 WeakPolarHBondContact CA-O 3.5Å
147	D	88.4	Confident	87.2	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	135.9	167.4	-179.4	23.4	0	0	0	109.1	N199 T278 M279 I281 R557	D147-N199 WeakPolarHBondContact OD1-CA 3.49Å; D147-N199 PolarHBondContact OD1-N 2.84Å; D147-T278 WeakPolarHBondContact O-CA 3.21Å; D147-M279 HydrophobicContact CB-CE 4.35Å; D147-M279 PolarHBondContact N-O 3.02Å; D147-M279 PolarHBondContact O-N 3.3Å; D147-M279 WeakPolarHBondContact OD2-CE 3.31Å; D147-I281 HydrophobicContact CB-CD1 3.88Å; D147-R557 WeakPolarHBondContact OD2-CD 3.39Å; D147-R557 IonicContact OD2-CZ 3.79Å; D147-R557 IonicContact OD2-NE 3.35Å; D147-R557 IonicContact OD2-NH1 3.23Å; D147-R557 PolarHBondContact OD2-NH1 3.04Å
148	N	90.5	Very high	88	Confident	11 Å²	11	43 Å²	43	6%	0.059	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.9	173.9	-60	-73.4	0	0	0	109.6	N199 L200 F276 Q277 T278	N148-N199 PolarHBondContact O-N 3.42Å; N148-L200 HydrophobicContact CB-CB 3.88Å; N148-L200 WeakPolarHBondContact CB-O 3.33Å; N148-L200 PolarHBondContact ND2-O 3.39Å; N148-L200 WeakPolarHBondContact O-CB 3.22Å; N148-L200 PolarHBondContact O-N 3.08Å; N148-F276 HydrophobicContact CB-CE1 4.44Å; N148-F276 HydrophobicContact CB-CE2 4.18Å; N148-F276 HydrophobicContact CB-CZ 3.7Å; N148-Q277 CarbonylContact C-O 3.57Å; N148-Q277 VanDerWaalsContact CA-O 3.27Å; N148-Q277 WeakPolarHBondContact CA-O 3.46Å; N148-T278 WeakPolarHBondContact OD1-CB 3.44Å; N148-T278 WeakPolarHBondContact OD1-CG2 3.5Å; N148-T278 PolarHBondContact OD1-OG1 2.95Å
149	V	91.3	Very high	88.6	Confident	5 Å²	5	42.5 Å²	42.5	3%	0.03	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.9	-177.7	-176	0	0	0	0	109.6	K151 F197 N198 F276 Q277 M279	V149-K151 HydrophobicContact CG1-CG 4.18Å; V149-F197 CarbonylContact C-O 3.51Å; V149-F197 VanDerWaalsContact CA-O 3.3Å; V149-F197 WeakPolarHBondContact CA-O 3.44Å; V149-N198 WeakPolarHBondContact CG1-OD1 3.38Å; V149-N198 WeakPolarHBondContact CG2-OD1 3.25Å; V149-F276 CarbonylContact O-C 3.49Å; V149-F276 WeakPolarHBondContact O-CA 3.48Å; V149-Q277 PolarHBondContact N-O 3.44Å; V149-Q277 PolarHBondContact O-N 3.41Å; V149-M279 HydrophobicContact CG2-CE 4.11Å
150	L	92.6	Very high	89.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.6	169.8	177.7	63.2	0	0	0	109.2	L172 E196 F197 L200 I236 F276	L150-L172 HydrophobicContact CD2-CD1 4.12Å; L150-L172 HydrophobicContact CD2-CD2 3.63Å; L150-E196 WeakPolarHBondContact O-CA 3.23Å; L150-F197 HydrophobicContact CB-CD2 4.44Å; L150-F197 HydrophobicContact CD2-CD2 4.32Å; L150-F197 PolarHBondContact N-O 3.09Å; L150-F197 PolarHBondContact O-N 3.04Å; L150-L200 HydrophobicContact CB-CD1 3.65Å; L150-I236 HydrophobicContact CD1-CD1 3.93Å; L150-F276 HydrophobicContact CB-CD2 4.08Å; L150-F276 HydrophobicContact CD1-CB 4.36Å; L150-F276 HydrophobicContact CD1-CD2 4.27Å
151	K	93.3	Very high	89.6	Confident	61 Å²	61	39 Å²	39	27%	0.265	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.1	166.7	-54.6	-161.5	-174.2	-144	0	108.9	V149 W153 E196 F241 S274 R275	V149-K151 HydrophobicContact CG1-CG 4.18Å; K151-W153 HydrophobicContact CB-CZ3 4.16Å; K151-E196 HydrophobicContact CD-CG 4.38Å; K151-E196 WeakPolarHBondContact CD-OE2 3.45Å; K151-E196 WeakPolarHBondContact CE-OE1 3.46Å; K151-E196 WeakPolarHBondContact CE-OE2 3.46Å; K151-E196 HydrophobicContact CG-CB 4.43Å; K151-E196 HydrophobicContact CG-CG 4.08Å; K151-E196 IonicContact NZ-OE1 3.28Å; K151-E196 PolarHBondContact NZ-OE1 2.73Å; K151-E196 IonicContact NZ-OE2 3.7Å; K151-E196 PolarHBondContact NZ-OE2 2.74Å; K151-F241 HydrophobicContact CB-CE1 3.95Å; K151-F241 HydrophobicContact CB-CZ 4.11Å; K151-S274 VanDerWaalsContact O-CA 3.32Å; K151-S274 WeakPolarHBondContact O-CA 3.43Å; K151-R275 PolarHBondContact N-O 2.65Å; K151-R275 PolarHBondContact O-N 2.85Å
152	L	93.9	Very high	89.5	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	131.1	-170.9	169.8	65.5	0	0	0	110.8	I154 L170 H194 F195 L206 L208 L272 K273	L152-I154 HydrophobicContact CD2-CG1 4.32Å; L152-I154 HydrophobicContact CG-CG1 4.31Å; L152-L170 HydrophobicContact CD2-CD1 3.76Å; L152-L170 HydrophobicContact CD2-CD2 3.81Å; L152-L170 HydrophobicContact CD2-CG 4.42Å; L152-H194 CarbonylContact O-C 3.56Å; L152-H194 WeakPolarHBondContact O-CA 3.37Å; L152-F195 PolarHBondContact N-O 3.13Å; L152-F195 PolarHBondContact O-N 2.93Å; L152-L206 HydrophobicContact CD1-CD2 4.38Å; L152-L206 HydrophobicContact CD2-CD1 3.99Å; L152-L206 HydrophobicContact CD2-CD2 4.39Å; L152-L208 HydrophobicContact CD2-CD2 4.42Å; L152-L272 HydrophobicContact CD1-CB 4.47Å; L152-K273 CarbonylContact C-O 3.59Å; L152-K273 WeakPolarHBondContact CA-O 3.42Å
153	W	93.9	Very high	89.1	Confident	48 Å²	48	42.7 Å²	42.7	18%	0.182	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.3	163.8	-71.3	-107.6	0	0	0	109.6	K151 I155 E193 H194 F241 L272 K273	K151-W153 HydrophobicContact CB-CZ3 4.16Å; W153-I155 HydrophobicContact CB-CG1 3.94Å; W153-E193 VanDerWaalsContact CA-O 3.31Å; W153-E193 WeakPolarHBondContact CA-O 3.42Å; W153-H194 HydrophobicContact CD2-CB 4.42Å; W153-H194 AromaticContact CD2-CD2 3.58Å; W153-H194 AromaticContact CE2-CD2 3.39Å; W153-H194 AromaticContact CE2-CG 3.79Å; W153-H194 AromaticContact CE3-CD2 3.67Å; W153-H194 HydrophobicContact CG-CB 4.43Å; W153-H194 AromaticContact CH2-CD2 3.42Å; W153-H194 VanDerWaalsContact CH2-CD2 3.42Å; W153-H194 WeakPolarHBondContact CH2-CD2 3.34Å; W153-H194 AromaticContact CH2-NE2 3.41Å; W153-H194 WeakPolarHBondContact CH2-NE2 3.33Å; W153-H194 HydrophobicContact CZ2-CB 4.42Å; W153-H194 AromaticContact CZ2-CD2 3.35Å; W153-H194 WeakPolarHBondContact CZ2-CD2 3.15Å; W153-H194 AromaticContact CZ2-CG 3.82Å; W153-H194 AromaticContact CZ2-NE2 3.73Å; W153-H194 AromaticContact CZ3-CD2 3.56Å; W153-H194 AromaticContact CZ3-NE2 3.69Å; W153-F241 HydrophobicContact CE3-CE1 4.18Å; W153-F241 HydrophobicContact CH2-CE1 4.25Å; W153-F241 HydrophobicContact CH2-CZ 4.07Å; W153-F241 HydrophobicContact CZ3-CD1 4.16Å; W153-F241 AromaticContact CZ3-CE1 3.4Å; W153-F241 HydrophobicContact CZ3-CE1 3.4Å; W153-F241 VanDerWaalsContact CZ3-CE1 3.4Å; W153-F241 AromaticContact CZ3-CZ 3.68Å; W153-F241 HydrophobicContact CZ3-CZ 3.68Å; W153-L272 WeakPolarHBondContact O-CA 3.45Å; W153-K273 HydrophobicContact CB-CB 4.24Å; W153-K273 HydrophobicContact CE3-CD 4.34Å; W153-K273 HydrophobicContact CE3-CG 4.36Å; W153-K273 PolarHBondContact N-O 3.39Å; W153-K273 PolarHBondContact O-N 3.05Å; W153-K273 VanDerWaalsContact O-N 3.12Å
154	I	94.4	Very high	89	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	97	165.9	-56.7	178.3	0	0	0	106	L152 C168 T180 W191 G192 E193 F195 L208 L270 L272	L152-I154 HydrophobicContact CD2-CG1 4.32Å; L152-I154 HydrophobicContact CG-CG1 4.31Å; I154-C168 HydrophobicContact CD1-CB 4.22Å; I154-T180 HydrophobicContact CB-CG2 4.1Å; I154-T180 HydrophobicContact CD1-CG2 3.61Å; I154-T180 HydrophobicContact CG1-CG2 4.41Å; I154-T180 HydrophobicContact CG2-CG2 4.02Å; I154-W191 HydrophobicContact CG2-CD2 4.49Å; I154-W191 HydrophobicContact CG2-CE3 4Å; I154-W191 HydrophobicContact CG2-CZ3 4.45Å; I154-W191 WeakPolarHBondContact O-CB 3.32Å; I154-G192 PolarHBondContact O-N 3.45Å; I154-E193 PolarHBondContact N-O 3.21Å; I154-E193 PolarHBondContact O-N 3.37Å; I154-F195 HydrophobicContact CB-CE2 4.43Å; I154-F195 HydrophobicContact CD1-CD2 4.23Å; I154-F195 HydrophobicContact CD1-CE2 3.78Å; I154-F195 HydrophobicContact CG1-CD2 4.31Å; I154-F195 HydrophobicContact CG1-CE2 4.05Å; I154-L208 HydrophobicContact CD1-CD1 3.84Å; I154-L208 HydrophobicContact CD1-CD2 3.74Å; I154-L208 HydrophobicContact CD1-CG 4.48Å; I154-L208 HydrophobicContact CG1-CD1 3.93Å; I154-L270 HydrophobicContact CG2-CD2 4.5Å; I154-L272 HydrophobicContact CB-CD2 4.23Å; I154-L272 HydrophobicContact CG1-CD2 4.11Å; I154-L272 HydrophobicContact CG2-CD2 4.01Å
155	I	93.6	Very high	89.1	Confident	23 Å²	23	46.6 Å²	46.6	12%	0.118	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-65.6	-166.7	-54.6	177.7	0	0	0	109.7	W153 F190 W191 G192 E243 R271 K273	W153-I155 HydrophobicContact CB-CG1 3.94Å; I155-F190 HydrophobicContact CG2-CD2 4.39Å; I155-F190 HydrophobicContact CG2-CE2 3.84Å; I155-W191 PolarHBondContact O-N 2.9Å; I155-G192 PolarHBondContact O-N 3.28Å; I155-E243 HydrophobicContact CD1-CG 4.24Å; I155-R271 HydrophobicContact CB-CB 4.42Å; I155-R271 HydrophobicContact CB-CG 4.42Å; I155-R271 WeakPolarHBondContact CB-O 3.4Å; I155-R271 HydrophobicContact CD1-CG 4.25Å; I155-R271 PolarHBondContact N-O 3.49Å; I155-R271 VanDerWaalsContact N-O 3.09Å; I155-K273 HydrophobicContact CD1-CB 3.96Å
156	E	93.9	Very high	89.3	Confident	25 Å²	25	45.4 Å²	45.4	12%	0.117	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	158.8	-172.2	56.6	177.8	150.7	0	0	113	V189 F190 W245 L270 R271	E156-V189 CarbonylContact C-O 3.43Å; E156-V189 WeakPolarHBondContact CA-O 3.46Å; E156-F190 HydrophobicContact CB-CD2 4.21Å; E156-W245 HydrophobicContact CG-CH2 3.65Å; E156-W245 HydrophobicContact CG-CZ2 4.15Å; E156-W245 HydrophobicContact CG-CZ3 4.35Å; E156-W245 WeakPolarHBondContact OE1-CZ2 3.42Å; E156-L270 CarbonylContact O-C 3.55Å; E156-L270 WeakPolarHBondContact O-CA 3.42Å; E156-R271 HydrophobicContact CG-CB 3.62Å; E156-R271 HydrophobicContact CG-CG 4.39Å; E156-R271 PolarHBondContact O-N 2.88Å; E156-R271 WeakPolarHBondContact OE1-CD 3.4Å; E156-R271 IonicContact OE1-CZ 3.81Å; E156-R271 IonicContact OE1-NE 3.87Å; E156-R271 IonicContact OE1-NH1 3.57Å; E156-R271 PolarHBondContact OE1-NH1 2.92Å
157	A	94	Very high	89.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.4	163.7	0	0	0	0	0	111.6	L160 V189 W191 S269 L270	A157-L160 HydrophobicContact CB-CD1 3.54Å; A157-L160 HydrophobicContact CB-CG 4.42Å; A157-V189 HydrophobicContact CB-CB 4.43Å; A157-V189 PolarHBondContact N-O 3.29Å; A157-V189 PolarHBondContact O-N 2.97Å; A157-W191 HydrophobicContact CB-CH2 3.8Å; A157-W191 HydrophobicContact CB-CZ3 3.58Å; A157-S269 VanDerWaalsContact CA-O 3.26Å; A157-S269 WeakPolarHBondContact CA-O 3.08Å; A157-L270 HydrophobicContact CB-CD2 3.81Å; A157-L270 HydrophobicContact CB-CG 4.42Å
158	R	92	Very high	89.8	Confident	94 Å²	94	42.4 Å²	42.4	36%	0.355	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	173.1	172.9	71.1	-178.2	-161	-136.4	3.1	111.5	L160 T188 W245 A268 S269	R158-L160 PolarHBondContact O-N 3.2Å; R158-T188 HydrophobicContact CB-CG2 4.43Å; R158-W245 HydrophobicContact CB-CH2 4.18Å; R158-W245 HydrophobicContact CB-CZ3 4.16Å; R158-W245 HydrophobicContact CG-CE3 4.34Å; R158-W245 HydrophobicContact CG-CH2 3.97Å; R158-W245 HydrophobicContact CG-CZ3 3.62Å; R158-A268 WeakPolarHBondContact O-CA 3.42Å; R158-S269 PolarHBondContact N-O 3.42Å; R158-S269 PolarHBondContact O-N 3.29Å
159	E	88.1	Confident	90	Very high	90 Å²	90	43 Å²	43	42%	0.421	20%	0.2	S	C	.	.	S	Bend	trans	61.8	11.5	173.4	-64.5	169.1	-105.4	0	0	115.5	N267	E159-N267 HydrophobicContact CB-CB 4.48Å; E159-N267 VanDerWaalsContact CB-O 3.26Å; E159-N267 WeakPolarHBondContact CB-O 3.01Å; E159-N267 WeakPolarHBondContact OE2-CB 3.43Å
160	L	87.4	Confident	90.1	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.016	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-75.5	155.3	173.2	-73.2	167.7	0	0	0	112.6	A157 R158 Y166 R185 V189 L210 L226 A268	A157-L160 HydrophobicContact CB-CD1 3.54Å; A157-L160 HydrophobicContact CB-CG 4.42Å; R158-L160 PolarHBondContact O-N 3.2Å; L160-Y166 HydrophobicContact CB-CE1 4.3Å; L160-Y166 HydrophobicContact CB-CE2 4.23Å; L160-Y166 HydrophobicContact CD1-CD1 3.95Å; L160-Y166 HydrophobicContact CD1-CD2 4.22Å; L160-Y166 HydrophobicContact CD1-CE1 4.33Å; L160-Y166 HydrophobicContact CD1-CG 3.9Å; L160-Y166 HydrophobicContact CD2-CD1 4.07Å; L160-Y166 HydrophobicContact CD2-CE1 3.86Å; L160-Y166 HydrophobicContact CG-CD1 4.49Å; L160-Y166 HydrophobicContact CG-CE1 4.41Å; L160-R185 WeakPolarHBondContact O-CD 3.42Å; L160-R185 PolarHBondContact O-NE 3.44Å; L160-R185 PolarHBondContact O-NH1 2.78Å; L160-V189 HydrophobicContact CD1-CB 4.48Å; L160-V189 HydrophobicContact CD1-CG2 3.87Å; L160-L210 HydrophobicContact CD1-CD2 4.27Å; L160-L210 HydrophobicContact CD2-CD2 3.83Å; L160-L226 HydrophobicContact CD2-CD1 3.69Å; L160-A268 HydrophobicContact CD2-CB 3.59Å; L160-A268 HydrophobicContact CG-CB 3.98Å
161	P	83.3	Confident	90.1	Very high	65 Å²	65	43.3 Å²	43.3	42%	0.422	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-59.1	137.5	173.8	-24.1	31.8	0	0	0	113.9	Y166	P161-Y166 WeakPolarHBondContact CB-OH 3.19Å; P161-Y166 WeakPolarHBondContact CD-OH 3.41Å; P161-Y166 WeakPolarHBondContact O-CE2 3.24Å; P161-Y166 PolarHBondContact O-OH 3.44Å
162	A	77.2	Confident	90	Very high	55 Å²	55	40.6 Å²	40.6	46%	0.455	19%	0.191	S	C	.	.	S	Bend	trans	-71.5	162.5	-179.5	0	0	0	0	0	113.6	K164	A162-K164 VanDerWaalsContact C-N 3.34Å; A162-K164 PolarHBondContact O-N 3.01Å
163	K	73.6	Confident	89.7	Confident	187 Å²	187	43 Å²	43	81%	0.813	20%	0.203	S	C	*	.	S	Bend	trans	60.1	37.8	173.9	-52.6	-178.1	-178.6	-178.2	0	113.9
164	K	84.4	Confident	89.3	Confident	96 Å²	96	46.2 Å²	46.2	42%	0.417	22%	0.224	S	C	.	.			trans	-141.3	159.7	175.6	-63.1	-63.4	158	-153	0	110.6	A162 Y166 P184 R185 K212	A162-K164 VanDerWaalsContact C-N 3.34Å; A162-K164 PolarHBondContact O-N 3.01Å; K164-Y166 HydrophobicContact CB-CE2 3.64Å; K164-Y166 WeakPolarHBondContact O-CE2 3.46Å; K164-P184 WeakPolarHBondContact O-CA 3.5Å; K164-R185 PolarHBondContact O-N 3.28Å; K164-K212 HydrophobicContact CB-CG 4.31Å; K164-K212 HydrophobicContact CG-CD 4.44Å
165	R	89.9	Confident	88.8	Confident	110 Å²	110	50 Å²	50	42%	0.415	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	149.5	173.6	-52.3	-178.1	76.1	112.3	-8.2	110.8	S182 K183 P184 K212 E213	R165-S182 VanDerWaalsContact CB-OG 3.31Å; R165-S182 WeakPolarHBondContact CB-OG 3.45Å; R165-S182 PolarHBondContact NE-O 3.4Å; R165-S182 PolarHBondContact NH2-O 3.46Å; R165-K183 CarbonylContact C-O 3.6Å; R165-K183 VanDerWaalsContact CA-O 3.23Å; R165-K183 WeakPolarHBondContact CA-O 3.27Å; R165-P184 HydrophobicContact CG-CB 4.14Å; R165-K212 WeakPolarHBondContact O-CA 3.18Å; R165-E213 HydrophobicContact CB-CB 4.15Å; R165-E213 WeakPolarHBondContact CD-OE2 2.92Å; R165-E213 IonicContact NE-OE2 3.3Å; R165-E213 PolarHBondContact O-N 2.79Å
166	Y	92	Very high	88.4	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.2	-171.8	-63.8	-86.9	0	0	0	111.2	L160 P161 K164 S182 K183 R185 V189 W191 Y211 K212 L226	L160-Y166 HydrophobicContact CB-CE1 4.3Å; L160-Y166 HydrophobicContact CB-CE2 4.23Å; L160-Y166 HydrophobicContact CD1-CD1 3.95Å; L160-Y166 HydrophobicContact CD1-CD2 4.22Å; L160-Y166 HydrophobicContact CD1-CE1 4.33Å; L160-Y166 HydrophobicContact CD1-CG 3.9Å; L160-Y166 HydrophobicContact CD2-CD1 4.07Å; L160-Y166 HydrophobicContact CD2-CE1 3.86Å; L160-Y166 HydrophobicContact CG-CD1 4.49Å; L160-Y166 HydrophobicContact CG-CE1 4.41Å; P161-Y166 WeakPolarHBondContact CB-OH 3.19Å; P161-Y166 WeakPolarHBondContact CD-OH 3.41Å; P161-Y166 WeakPolarHBondContact O-CE2 3.24Å; P161-Y166 PolarHBondContact O-OH 3.44Å; K164-Y166 HydrophobicContact CB-CE2 3.64Å; K164-Y166 WeakPolarHBondContact O-CE2 3.46Å; Y166-S182 CarbonylContact O-C 3.56Å; Y166-S182 WeakPolarHBondContact O-CA 3.43Å; Y166-K183 PolarHBondContact N-O 3.24Å; Y166-K183 PolarHBondContact O-N 2.89Å; Y166-R185 HydrophobicContact CD2-CB 4.29Å; Y166-R185 HydrophobicContact CE2-CB 4.04Å; Y166-V189 HydrophobicContact CD2-CG2 3.82Å; Y166-V189 HydrophobicContact CG-CG2 4.38Å; Y166-W191 WeakPolarHBondContact O-CZ2 3.49Å; Y166-W191 PolarHBondContact O-NE1 3.45Å; Y166-Y211 VanDerWaalsContact CA-O 3.27Å; Y166-Y211 WeakPolarHBondContact CA-O 3.5Å; Y166-Y211 WeakPolarHBondContact CD1-O 3.28Å; Y166-K212 HydrophobicContact CD1-CB 3.98Å; Y166-K212 HydrophobicContact CE1-CB 3.67Å; Y166-K212 HydrophobicContact CE1-CD 4.4Å; Y166-K212 HydrophobicContact CE1-CG 4.01Å; Y166-L226 HydrophobicContact CD1-CD1 3.74Å; Y166-L226 HydrophobicContact CE1-CD1 3.53Å
167	Y	92.9	Very high	88.1	Confident	18 Å²	18	50.4 Å²	50.4	7%	0.071	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	152.7	173.4	66.5	-96.1	0	0	0	110.8	E169 R179 T180 Y211 S223	Y167-E169 HydrophobicContact CD2-CG 4.27Å; Y167-E169 HydrophobicContact CE2-CG 3.96Å; Y167-R179 HydrophobicContact CD2-CG 3.64Å; Y167-R179 HydrophobicContact CE2-CG 4.19Å; Y167-R179 HydrophobicContact CG-CG 4.44Å; Y167-T180 WeakPolarHBondContact CA-OG1 3.41Å; Y167-Y211 HydrophobicContact CD2-CD2 4.12Å; Y167-Y211 HydrophobicContact CD2-CG 4.42Å; Y167-Y211 AromaticContact CE2-CD2 3.52Å; Y167-Y211 HydrophobicContact CE2-CD2 3.52Å; Y167-Y211 HydrophobicContact CE2-CE2 4.34Å; Y167-Y211 AromaticContact CE2-CG 3.65Å; Y167-Y211 HydrophobicContact CE2-CG 3.65Å; Y167-Y211 VanDerWaalsContact CZ-CB 3.4Å; Y167-Y211 AromaticContact CZ-CG 3.71Å; Y167-Y211 PolarHBondContact N-O 2.86Å; Y167-Y211 PolarHBondContact O-N 2.65Å; Y167-S223 WeakPolarHBondContact OH-CB 3.47Å; Y167-S223 PolarHBondContact OH-OG 2.98Å
168	C	93.9	Very high	87.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	140.5	172.1	-59.7	0	0	0	0	110.5	I154 R179 T180 H209	I154-C168 HydrophobicContact CD1-CB 4.22Å; C168-R179 CarbonylContact O-C 3.6Å; C168-R179 VanDerWaalsContact O-CA 3.29Å; C168-R179 WeakPolarHBondContact O-CA 3.14Å; C168-R179 VanDerWaalsContact O-CG 3.24Å; C168-R179 WeakPolarHBondContact O-CG 3.4Å; C168-T180 HydrophobicContact CB-CG2 3.94Å; C168-T180 PolarHBondContact N-OG1 3.1Å; C168-T180 PolarHBondContact O-N 2.87Å; C168-H209 CarbonylContact C-O 3.52Å; C168-H209 WeakPolarHBondContact CA-O 3.33Å
169	E	93.9	Very high	87.8	Confident	23 Å²	23	48 Å²	48	11%	0.107	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.2	163	-75	176.3	178.6	0	0	109.1	Y167 L176 R179 L208 H209 Y211	Y167-E169 HydrophobicContact CD2-CG 4.27Å; Y167-E169 HydrophobicContact CE2-CG 3.96Å; E169-L176 HydrophobicContact CB-CD1 3.76Å; E169-L176 HydrophobicContact CG-CD1 4.12Å; E169-R179 HydrophobicContact CG-CB 4.33Å; E169-R179 HydrophobicContact CG-CG 3.81Å; E169-R179 IonicContact OE1-CZ 2.74Å; E169-R179 IonicContact OE1-NE 3.76Å; E169-R179 PolarHBondContact OE1-NE 3.46Å; E169-R179 IonicContact OE1-NH2 2.66Å; E169-R179 PolarHBondContact OE1-NH2 3.3Å; E169-L208 CarbonylContact O-C 3.6Å; E169-L208 WeakPolarHBondContact O-CA 3.31Å; E169-H209 HydrophobicContact CB-CB 4.26Å; E169-H209 PolarHBondContact N-O 2.93Å; E169-H209 PolarHBondContact O-N 2.73Å; E169-Y211 HydrophobicContact CB-CE2 4.03Å; E169-Y211 VanDerWaalsContact CD-CE2 3.47Å; E169-Y211 HydrophobicContact CG-CD2 4.22Å; E169-Y211 HydrophobicContact CG-CE2 3.88Å; E169-Y211 VanDerWaalsContact OE2-CE2 3.24Å; E169-Y211 WeakPolarHBondContact OE2-CE2 3.48Å; E169-Y211 PolarHBondContact OE2-OH 3.23Å
170	L	93.6	Very high	87.9	Confident	1 Å²	1	44 Å²	44	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115.6	-178.7	164.2	57.8	0	0	0	109.4	L152 L172 Y177 A178 F195 F197 L206 L208	L152-L170 HydrophobicContact CD2-CD1 3.76Å; L152-L170 HydrophobicContact CD2-CD2 3.81Å; L152-L170 HydrophobicContact CD2-CG 4.42Å; L170-L172 HydrophobicContact CD1-CD2 4.26Å; L170-Y177 PolarHBondContact O-N 2.87Å; L170-A178 HydrophobicContact CB-CB 4.26Å; L170-A178 HydrophobicContact CD2-CB 4.09Å; L170-A178 PolarHBondContact N-O 3.44Å; L170-A178 PolarHBondContact O-N 3Å; L170-F195 HydrophobicContact CD2-CB 4.23Å; L170-F195 HydrophobicContact CD2-CG 4.24Å; L170-F197 HydrophobicContact CD2-CE2 3.51Å; L170-F197 HydrophobicContact CD2-CZ 3.67Å; L170-L206 HydrophobicContact CD1-CD1 3.19Å; L170-L208 HydrophobicContact CB-CD2 3.79Å; L170-L208 HydrophobicContact CD1-CD2 3.59Å; L170-L208 HydrophobicContact CG-CD2 4.26Å
171	C	92.1	Very high	87.9	Confident	11 Å²	11	45 Å²	45	7%	0.074	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	144.4	177.2	-57	0	0	0	0	111.6	M175 R207	C171-M175 CarbonylContact C-O 3.52Å; C171-M175 WeakPolarHBondContact CA-O 3.26Å; C171-M175 WeakPolarHBondContact CB-O 3.41Å; C171-R207 HydrophobicContact CB-CB 4.45Å; C171-R207 PolarHBondContact N-O 2.98Å; C171-R207 PolarHBondContact O-N 3.42Å; C171-R207 VanDerWaalsContact O-O 3.13Å
172	L	90.9	Very high	88.1	Confident	4 Å²	4	43 Å²	43	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	115.4	172.1	-56.9	-179.5	0	0	0	107	L150 L170 D174 M175 Y177 L200 V203 L206	L150-L172 HydrophobicContact CD2-CD1 4.12Å; L150-L172 HydrophobicContact CD2-CD2 3.63Å; L170-L172 HydrophobicContact CD1-CD2 4.26Å; L172-D174 PolarHBondContact O-N 3.3Å; L172-M175 PolarHBondContact N-O 2.83Å; L172-M175 WeakPolarHBondContact O-CB 3.38Å; L172-M175 PolarHBondContact O-N 3.18Å; L172-M175 VanDerWaalsContact O-N 3.07Å; L172-Y177 HydrophobicContact CB-CD2 3.69Å; L172-Y177 HydrophobicContact CB-CE2 3.8Å; L172-Y177 HydrophobicContact CD1-CD1 4.07Å; L172-Y177 HydrophobicContact CD1-CD2 3.76Å; L172-Y177 HydrophobicContact CD1-CE1 4.25Å; L172-Y177 HydrophobicContact CD1-CE2 3.97Å; L172-Y177 HydrophobicContact CD1-CG 3.82Å; L172-Y177 HydrophobicContact CG-CD2 3.72Å; L172-Y177 HydrophobicContact CG-CE2 4.18Å; L172-Y177 HydrophobicContact CG-CG 4.06Å; L172-L200 HydrophobicContact CD1-CD1 3.82Å; L172-L200 HydrophobicContact CD1-CD2 3.83Å; L172-V203 HydrophobicContact CB-CG1 3.87Å; L172-V203 HydrophobicContact CB-CG2 4.13Å; L172-V203 HydrophobicContact CD1-CG2 4.36Å; L172-V203 HydrophobicContact CD2-CG1 4.39Å; L172-L206 HydrophobicContact CD2-CB 4.28Å; L172-L206 HydrophobicContact CD2-CD1 3.86Å
173	D	88.3	Confident	88.6	Confident	49 Å²	49	41.7 Å²	41.7	26%	0.262	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	39.6	65	-170.1	-68.5	-36.9	0	0	0	113.6	M175 V203 R204 N205	D173-M175 PolarHBondContact O-N 3.39Å; D173-V203 WeakPolarHBondContact OD2-CA 3.34Å; D173-R204 PolarHBondContact OD2-N 3.48Å; D173-N205 PolarHBondContact N-O 2.84Å; D173-N205 WeakPolarHBondContact OD1-CB 3.32Å; D173-N205 PolarHBondContact OD1-N 3.2Å; D173-N205 PolarHBondContact OD1-ND2 2.87Å
174	D	84.8	Confident	89.2	Confident	117 Å²	117	35.6 Å²	35.6	63%	0.626	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.3	-19.4	-176.6	-69.2	-72.8	0	0	0	116.6	L172 R207	L172-D174 PolarHBondContact O-N 3.3Å; D174-R207 VanDerWaalsContact CG-NH2 3.28Å; D174-R207 IonicContact OD1-CZ 2.83Å; D174-R207 IonicContact OD1-NH1 2.67Å; D174-R207 PolarHBondContact OD1-NH1 3.47Å; D174-R207 IonicContact OD1-NH2 2.72Å; D174-R207 IonicContact OD2-CZ 2.66Å; D174-R207 IonicContact OD2-NH1 3.61Å; D174-R207 PolarHBondContact OD2-NH1 2.87Å; D174-R207 IonicContact OD2-NH2 3.53Å; D174-R207 PolarHBondContact OD2-NH2 3.14Å
175	M	84.9	Confident	89.1	Confident	79 Å²	79	33.8 Å²	33.8	39%	0.389	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	129	175.2	-56.5	-165.4	90.5	0	0	111.5	C171 L172 D173 Y177	C171-M175 CarbonylContact C-O 3.52Å; C171-M175 WeakPolarHBondContact CA-O 3.26Å; C171-M175 WeakPolarHBondContact CB-O 3.41Å; L172-M175 PolarHBondContact N-O 2.83Å; L172-M175 WeakPolarHBondContact O-CB 3.38Å; L172-M175 PolarHBondContact O-N 3.18Å; L172-M175 VanDerWaalsContact O-N 3.07Å; D173-M175 PolarHBondContact O-N 3.39Å; M175-Y177 HydrophobicContact CB-CD2 4.21Å; M175-Y177 HydrophobicContact CB-CE2 3.9Å; M175-Y177 WeakPolarHBondContact O-CD2 3.43Å
176	L	85.4	Confident	88.5	Confident	45 Å²	45	34.5 Å²	34.5	24%	0.236	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	129.3	172.4	-175.5	70.4	0	0	0	111	I99 E169 A178	I99-L176 HydrophobicContact CD1-CD2 4.3Å; I99-L176 HydrophobicContact CD1-CG 4.05Å; I99-L176 HydrophobicContact CG1-CD2 4.13Å; I99-L176 HydrophobicContact CG1-CG 4.23Å; I99-L176 HydrophobicContact CG2-CD2 4.24Å; E169-L176 HydrophobicContact CB-CD1 3.76Å; E169-L176 HydrophobicContact CG-CD1 4.12Å; L176-A178 WeakPolarHBondContact CD1-O 3.09Å
177	Y	86.9	Confident	87.6	Confident	12 Å²	12	40 Å²	40	5%	0.047	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-31.3	179.8	-91.9	-95.5	0	0	0	114	K93 H96 I99 L170 L172 M175 F197 L200	K93-Y177 HydrophobicContact CD-CE1 3.79Å; H96-Y177 WeakPolarHBondContact CB-O 3.43Å; I99-Y177 WeakPolarHBondContact CD1-O 3.49Å; L170-Y177 PolarHBondContact O-N 2.87Å; L172-Y177 HydrophobicContact CB-CD2 3.69Å; L172-Y177 HydrophobicContact CB-CE2 3.8Å; L172-Y177 HydrophobicContact CD1-CD1 4.07Å; L172-Y177 HydrophobicContact CD1-CD2 3.76Å; L172-Y177 HydrophobicContact CD1-CE1 4.25Å; L172-Y177 HydrophobicContact CD1-CE2 3.97Å; L172-Y177 HydrophobicContact CD1-CG 3.82Å; L172-Y177 HydrophobicContact CG-CD2 3.72Å; L172-Y177 HydrophobicContact CG-CE2 4.18Å; L172-Y177 HydrophobicContact CG-CG 4.06Å; M175-Y177 HydrophobicContact CB-CD2 4.21Å; M175-Y177 HydrophobicContact CB-CE2 3.9Å; M175-Y177 WeakPolarHBondContact O-CD2 3.43Å; Y177-F197 AromaticContact CD1-CD1 3.74Å; Y177-F197 HydrophobicContact CD1-CD1 3.74Å; Y177-F197 AromaticContact CD1-CE1 3.91Å; Y177-F197 HydrophobicContact CD1-CE1 3.91Å; Y177-F197 HydrophobicContact CD1-CG 4.42Å; Y177-F197 HydrophobicContact CG-CE1 4.43Å; Y177-L200 HydrophobicContact CD1-CD2 4.22Å; Y177-L200 HydrophobicContact CE1-CD2 3.45Å; Y177-L200 VanDerWaalsContact CE1-CD2 3.45Å
178	A	89.6	Confident	87.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	177.6	169.5	0	0	0	0	0	112.7	H96 L170 L176 F195 F197	H96-A178 HydrophobicContact CB-CB 3.85Å; L170-A178 HydrophobicContact CB-CB 4.26Å; L170-A178 HydrophobicContact CD2-CB 4.09Å; L170-A178 PolarHBondContact N-O 3.44Å; L170-A178 PolarHBondContact O-N 3Å; L176-A178 WeakPolarHBondContact CD1-O 3.09Å; A178-F195 HydrophobicContact CB-CD1 3.61Å; A178-F195 HydrophobicContact CB-CE1 3.69Å; A178-F195 HydrophobicContact CB-CG 4.45Å; A178-F197 HydrophobicContact CB-CZ 4.07Å
179	R	90.4	Very high	86.9	Confident	43 Å²	43	41.4 Å²	41.4	16%	0.162	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.6	167.2	-169.7	-168.5	-80.4	161.6	-8	109.7	S98 Y167 C168 E169 Q482	S98-R179 WeakPolarHBondContact CB-O 3.37Å; S98-R179 PolarHBondContact OG-N 3.47Å; S98-R179 VanDerWaalsContact OG-N 3.07Å; S98-R179 PolarHBondContact OG-O 3.19Å; Y167-R179 HydrophobicContact CD2-CG 3.64Å; Y167-R179 HydrophobicContact CE2-CG 4.19Å; Y167-R179 HydrophobicContact CG-CG 4.44Å; C168-R179 CarbonylContact O-C 3.6Å; C168-R179 VanDerWaalsContact O-CA 3.29Å; C168-R179 WeakPolarHBondContact O-CA 3.14Å; C168-R179 VanDerWaalsContact O-CG 3.24Å; C168-R179 WeakPolarHBondContact O-CG 3.4Å; E169-R179 HydrophobicContact CG-CB 4.33Å; E169-R179 HydrophobicContact CG-CG 3.81Å; E169-R179 IonicContact OE1-CZ 2.74Å; E169-R179 IonicContact OE1-NE 3.76Å; E169-R179 PolarHBondContact OE1-NE 3.46Å; E169-R179 IonicContact OE1-NH2 2.66Å; E169-R179 PolarHBondContact OE1-NH2 3.3Å; R179-Q482 PolarHBondContact O-NE2 2.77Å
180	T	90.9	Very high	86.8	Confident	5 Å²	5	44.7 Å²	44.7	3%	0.031	24%	0.237	C	C	.	.			trans	-74.2	168.3	171.2	68.2	0	0	0	0	112	I154 Y167 C168 W191 E193 F195	I154-T180 HydrophobicContact CB-CG2 4.1Å; I154-T180 HydrophobicContact CD1-CG2 3.61Å; I154-T180 HydrophobicContact CG1-CG2 4.41Å; I154-T180 HydrophobicContact CG2-CG2 4.02Å; Y167-T180 WeakPolarHBondContact CA-OG1 3.41Å; C168-T180 HydrophobicContact CB-CG2 3.94Å; C168-T180 PolarHBondContact N-OG1 3.1Å; C168-T180 PolarHBondContact O-N 2.87Å; T180-W191 HydrophobicContact CG2-CG 4.41Å; T180-W191 PolarHBondContact OG1-NE1 3.46Å; T180-E193 WeakPolarHBondContact CA-OE2 3.48Å; T180-F195 HydrophobicContact CG2-CE2 4.13Å; T180-F195 HydrophobicContact CG2-CZ 4.06Å
181	T	87.6	Confident	86.6	Confident	25 Å²	25	44.6 Å²	44.6	15%	0.153	24%	0.236	C	C	.	.			trans	-61.2	158.8	162.3	66.4	0	0	0	0	111.1	W191 E193 E483	T181-W191 VanDerWaalsContact O-CD1 3.31Å; T181-W191 PolarHBondContact O-NE1 2.9Å; T181-E193 VanDerWaalsContact CB-OE1 3.27Å; T181-E193 WeakPolarHBondContact CB-OE1 3.41Å; T181-E193 WeakPolarHBondContact CG2-OE1 3.21Å; T181-E193 PolarHBondContact N-OE1 2.99Å; T181-E193 PolarHBondContact N-OE2 2.95Å; T181-E193 VanDerWaalsContact N-OE2 3.14Å; T181-E193 PolarHBondContact OG1-OE1 2.86Å; T181-E483 HydrophobicContact CG2-CB 4.05Å; T181-E483 HydrophobicContact CG2-CG 3.98Å
182	S	87.6	Confident	86.4	Confident	23 Å²	23	44.7 Å²	44.7	16%	0.161	24%	0.239	C	C	.	.			trans	-92.7	101.4	174.9	-175.3	0	0	0	0	109.5	R165 Y166 E213	R165-S182 VanDerWaalsContact CB-OG 3.31Å; R165-S182 WeakPolarHBondContact CB-OG 3.45Å; R165-S182 PolarHBondContact NE-O 3.4Å; R165-S182 PolarHBondContact NH2-O 3.46Å; Y166-S182 CarbonylContact O-C 3.56Å; Y166-S182 WeakPolarHBondContact O-CA 3.43Å; S182-E213 WeakPolarHBondContact CB-OE2 3.37Å; S182-E213 PolarHBondContact OG-OE2 2.76Å
183	K	87.5	Confident	86.4	Confident	27 Å²	27	44.6 Å²	44.6	12%	0.117	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.7	-175.9	-68.4	-76.8	-161.3	-179.9	0	111.3	R165 Y166 V189 F190 W191 E483	R165-K183 CarbonylContact C-O 3.6Å; R165-K183 VanDerWaalsContact CA-O 3.23Å; R165-K183 WeakPolarHBondContact CA-O 3.27Å; Y166-K183 PolarHBondContact N-O 3.24Å; Y166-K183 PolarHBondContact O-N 2.89Å; K183-V189 HydrophobicContact CB-CG1 3.7Å; K183-F190 WeakPolarHBondContact CG-O 3.41Å; K183-W191 VanDerWaalsContact CG-CD1 3.45Å; K183-W191 HydrophobicContact CG-CG 4.2Å; K183-E483 VanDerWaalsContact CE-OE1 3.25Å; K183-E483 WeakPolarHBondContact CE-OE1 3.41Å; K183-E483 VanDerWaalsContact NZ-CG 3.25Å; K183-E483 IonicContact NZ-OE1 3.82Å; K183-E483 PolarHBondContact NZ-OE1 3.45Å
184	P	85.3	Confident	86.4	Confident	60 Å²	60	44.5 Å²	44.5	39%	0.39	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	142.3	174.2	30.8	-32.9	0	0	0	111.5	K164 R165 T186	K164-P184 WeakPolarHBondContact O-CA 3.5Å; R165-P184 HydrophobicContact CG-CB 4.14Å; P184-T186 PolarHBondContact O-N 2.76Å
185	R	81.9	Confident	86.6	Confident	58 Å²	58	39 Å²	39	22%	0.219	21%	0.207	C	C	.	.			trans	-75.2	112.4	164.7	-174.4	179.4	178.8	-128.6	-22.4	109.9	L160 K164 Y166 D187 V189	L160-R185 WeakPolarHBondContact O-CD 3.42Å; L160-R185 PolarHBondContact O-NE 3.44Å; L160-R185 PolarHBondContact O-NH1 2.78Å; K164-R185 PolarHBondContact O-N 3.28Å; Y166-R185 HydrophobicContact CD2-CB 4.29Å; Y166-R185 HydrophobicContact CE2-CB 4.04Å; R185-D187 PolarHBondContact NE-O 2.8Å; R185-D187 PolarHBondContact NH2-O 3.16Å; R185-D187 IonicContact NH2-OD1 3.9Å; R185-D187 PolarHBondContact NH2-OD1 3.44Å; R185-D187 VanDerWaalsContact NH2-OD1 3.11Å; R185-V189 HydrophobicContact CB-CG2 3.65Å; R185-V189 HydrophobicContact CG-CG2 4.07Å
186	T	77.3	Confident	86.7	Confident	124 Å²	124	38.7 Å²	38.7	76%	0.761	21%	0.205	S	C	*	.	S	Bend	trans	-86.3	-76.4	161.3	48.2	0	0	0	0	108.3	P184	P184-T186 PolarHBondContact O-N 2.76Å
187	D	73.8	Confident	86.8	Confident	115 Å²	115	37.3 Å²	37.3	62%	0.615	20%	0.197	S	C	*	.	S	Bend	trans	-118.8	-57.2	168.2	-175.1	30.4	0	0	0	112.6	R185	R185-D187 PolarHBondContact NE-O 2.8Å; R185-D187 PolarHBondContact NH2-O 3.16Å; R185-D187 IonicContact NH2-OD1 3.9Å; R185-D187 PolarHBondContact NH2-OD1 3.44Å; R185-D187 VanDerWaalsContact NH2-OD1 3.11Å
188	T	84.1	Confident	86.8	Confident	47 Å²	47	39.3 Å²	39.3	29%	0.288	21%	0.208	S	C	.	.	S	Bend	trans	-93.3	179.7	158.6	58	0	0	0	0	110	R158	R158-T188 HydrophobicContact CB-CG2 4.43Å
189	V	88.6	Confident	86.4	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	101.8	160.6	-176.5	0	0	0	0	106.6	E156 A157 L160 Y166 K183 R185 W191	E156-V189 CarbonylContact C-O 3.43Å; E156-V189 WeakPolarHBondContact CA-O 3.46Å; A157-V189 HydrophobicContact CB-CB 4.43Å; A157-V189 PolarHBondContact N-O 3.29Å; A157-V189 PolarHBondContact O-N 2.97Å; L160-V189 HydrophobicContact CD1-CB 4.48Å; L160-V189 HydrophobicContact CD1-CG2 3.87Å; Y166-V189 HydrophobicContact CD2-CG2 3.82Å; Y166-V189 HydrophobicContact CG-CG2 4.38Å; K183-V189 HydrophobicContact CB-CG1 3.7Å; R185-V189 HydrophobicContact CB-CG2 3.65Å; R185-V189 HydrophobicContact CG-CG2 4.07Å; V189-W191 HydrophobicContact CB-CH2 4.2Å; V189-W191 HydrophobicContact CB-CZ2 4.44Å; V189-W191 HydrophobicContact CB-CZ3 4.4Å; V189-W191 HydrophobicContact CG1-CD2 4.13Å; V189-W191 HydrophobicContact CG1-CE3 4.32Å; V189-W191 HydrophobicContact CG1-CH2 3.78Å; V189-W191 HydrophobicContact CG1-CZ2 3.54Å; V189-W191 HydrophobicContact CG1-CZ3 4.17Å
190	F	90.3	Very high	86.1	Confident	92 Å²	92	41.4 Å²	41.4	40%	0.404	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	129.7	175.6	-174.5	-91.8	0	0	0	110.2	I155 E156 K183 Y484	I155-F190 HydrophobicContact CG2-CD2 4.39Å; I155-F190 HydrophobicContact CG2-CE2 3.84Å; E156-F190 HydrophobicContact CB-CD2 4.21Å; K183-F190 WeakPolarHBondContact CG-O 3.41Å; F190-Y484 AromaticContact CE1-CD1 3.98Å; F190-Y484 HydrophobicContact CE1-CD1 3.98Å; F190-Y484 HydrophobicContact CE1-CG 4.12Å
191	W	90.6	Very high	85.8	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-50	171.1	-67.5	-82.6	0	0	0	110.6	I154 I155 A157 Y166 T180 T181 K183 V189 E193 L210 L270 Y484	I154-W191 HydrophobicContact CG2-CD2 4.49Å; I154-W191 HydrophobicContact CG2-CE3 4Å; I154-W191 HydrophobicContact CG2-CZ3 4.45Å; I154-W191 WeakPolarHBondContact O-CB 3.32Å; I155-W191 PolarHBondContact O-N 2.9Å; A157-W191 HydrophobicContact CB-CH2 3.8Å; A157-W191 HydrophobicContact CB-CZ3 3.58Å; Y166-W191 WeakPolarHBondContact O-CZ2 3.49Å; Y166-W191 PolarHBondContact O-NE1 3.45Å; T180-W191 HydrophobicContact CG2-CG 4.41Å; T180-W191 PolarHBondContact OG1-NE1 3.46Å; T181-W191 VanDerWaalsContact O-CD1 3.31Å; T181-W191 PolarHBondContact O-NE1 2.9Å; K183-W191 VanDerWaalsContact CG-CD1 3.45Å; K183-W191 HydrophobicContact CG-CG 4.2Å; V189-W191 HydrophobicContact CB-CH2 4.2Å; V189-W191 HydrophobicContact CB-CZ2 4.44Å; V189-W191 HydrophobicContact CB-CZ3 4.4Å; V189-W191 HydrophobicContact CG1-CD2 4.13Å; V189-W191 HydrophobicContact CG1-CE3 4.32Å; V189-W191 HydrophobicContact CG1-CH2 3.78Å; V189-W191 HydrophobicContact CG1-CZ2 3.54Å; V189-W191 HydrophobicContact CG1-CZ3 4.17Å; W191-E193 HydrophobicContact CB-CB 4.43Å; W191-E193 HydrophobicContact CB-CG 4.09Å; W191-E193 PolarHBondContact O-N 2.88Å; W191-L210 HydrophobicContact CH2-CD1 3.96Å; W191-L210 HydrophobicContact CZ2-CD1 4.39Å; W191-L270 HydrophobicContact CH2-CD2 4.17Å; W191-L270 HydrophobicContact CZ3-CD2 3.67Å; W191-Y484 WeakPolarHBondContact O-CB 3.42Å
192	G	88.1	Confident	85.7	Confident	13 Å²	13	47.1 Å²	47.1	13%	0.134	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	66.3	14.3	-175.4	0	0	0	0	0	114.3	I154 I155	I154-G192 PolarHBondContact O-N 3.45Å; I155-G192 PolarHBondContact O-N 3.28Å
193	E	89.9	Confident	85.8	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	128.4	-167.4	-70.8	176.9	-131.9	0	0	112	W153 I154 T180 T181 W191 F195 Q482	W153-E193 VanDerWaalsContact CA-O 3.31Å; W153-E193 WeakPolarHBondContact CA-O 3.42Å; I154-E193 PolarHBondContact N-O 3.21Å; I154-E193 PolarHBondContact O-N 3.37Å; T180-E193 WeakPolarHBondContact CA-OE2 3.48Å; T181-E193 VanDerWaalsContact CB-OE1 3.27Å; T181-E193 WeakPolarHBondContact CB-OE1 3.41Å; T181-E193 WeakPolarHBondContact CG2-OE1 3.21Å; T181-E193 PolarHBondContact N-OE1 2.99Å; T181-E193 PolarHBondContact N-OE2 2.95Å; T181-E193 VanDerWaalsContact N-OE2 3.14Å; T181-E193 PolarHBondContact OG1-OE1 2.86Å; W191-E193 HydrophobicContact CB-CB 4.43Å; W191-E193 HydrophobicContact CB-CG 4.09Å; W191-E193 PolarHBondContact O-N 2.88Å; E193-F195 HydrophobicContact CB-CE2 3.73Å; E193-F195 HydrophobicContact CB-CZ 3.88Å; E193-Q482 PolarHBondContact OE2-NE2 2.78Å
194	H	88.8	Confident	86	Confident	48 Å²	48	55 Å²	55	22%	0.222	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	139	175.1	178.2	-125.8	0	0	0	111.2	L152 W153 E196	L152-H194 CarbonylContact O-C 3.56Å; L152-H194 WeakPolarHBondContact O-CA 3.37Å; W153-H194 HydrophobicContact CD2-CB 4.42Å; W153-H194 AromaticContact CD2-CD2 3.58Å; W153-H194 AromaticContact CE2-CD2 3.39Å; W153-H194 AromaticContact CE2-CG 3.79Å; W153-H194 AromaticContact CE3-CD2 3.67Å; W153-H194 HydrophobicContact CG-CB 4.43Å; W153-H194 AromaticContact CH2-CD2 3.42Å; W153-H194 VanDerWaalsContact CH2-CD2 3.42Å; W153-H194 WeakPolarHBondContact CH2-CD2 3.34Å; W153-H194 AromaticContact CH2-NE2 3.41Å; W153-H194 WeakPolarHBondContact CH2-NE2 3.33Å; W153-H194 HydrophobicContact CZ2-CB 4.42Å; W153-H194 AromaticContact CZ2-CD2 3.35Å; W153-H194 WeakPolarHBondContact CZ2-CD2 3.15Å; W153-H194 AromaticContact CZ2-CG 3.82Å; W153-H194 AromaticContact CZ2-NE2 3.73Å; W153-H194 AromaticContact CZ3-CD2 3.56Å; W153-H194 AromaticContact CZ3-NE2 3.69Å; H194-E196 IonicContact CE1-OE2 3.73Å
195	F	88.8	Confident	86.4	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.009	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	129	172.7	-54.9	-85.9	0	0	0	109.5	H96 L152 I154 L170 A178 T180 E193 F197	H96-F195 AromaticContact CE1-CD1 3.95Å; H96-F195 AromaticContact CE1-CE1 3.7Å; H96-F195 AromaticContact NE2-CD1 3.77Å; H96-F195 AromaticContact NE2-CE1 3.98Å; L152-F195 PolarHBondContact N-O 3.13Å; L152-F195 PolarHBondContact O-N 2.93Å; I154-F195 HydrophobicContact CB-CE2 4.43Å; I154-F195 HydrophobicContact CD1-CD2 4.23Å; I154-F195 HydrophobicContact CD1-CE2 3.78Å; I154-F195 HydrophobicContact CG1-CD2 4.31Å; I154-F195 HydrophobicContact CG1-CE2 4.05Å; L170-F195 HydrophobicContact CD2-CB 4.23Å; L170-F195 HydrophobicContact CD2-CG 4.24Å; A178-F195 HydrophobicContact CB-CD1 3.61Å; A178-F195 HydrophobicContact CB-CE1 3.69Å; A178-F195 HydrophobicContact CB-CG 4.45Å; T180-F195 HydrophobicContact CG2-CE2 4.13Å; T180-F195 HydrophobicContact CG2-CZ 4.06Å; E193-F195 HydrophobicContact CB-CE2 3.73Å; E193-F195 HydrophobicContact CB-CZ 3.88Å; F195-F197 HydrophobicContact CB-CE2 3.57Å; F195-F197 HydrophobicContact CB-CZ 3.89Å
196	E	88	Confident	87	Confident	72 Å²	72	51.9 Å²	51.9	34%	0.336	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.7	176	172.1	165	172.5	0	0	110.5	L150 K151 H194 N198	L150-E196 WeakPolarHBondContact O-CA 3.23Å; K151-E196 HydrophobicContact CD-CG 4.38Å; K151-E196 WeakPolarHBondContact CD-OE2 3.45Å; K151-E196 WeakPolarHBondContact CE-OE1 3.46Å; K151-E196 WeakPolarHBondContact CE-OE2 3.46Å; K151-E196 HydrophobicContact CG-CB 4.43Å; K151-E196 HydrophobicContact CG-CG 4.08Å; K151-E196 IonicContact NZ-OE1 3.28Å; K151-E196 PolarHBondContact NZ-OE1 2.73Å; K151-E196 IonicContact NZ-OE2 3.7Å; K151-E196 PolarHBondContact NZ-OE2 2.74Å; H194-E196 IonicContact CE1-OE2 3.73Å; E196-N198 WeakPolarHBondContact CG-ND2 3.47Å; E196-N198 PolarHBondContact OE1-ND2 3.37Å
197	F	87.6	Confident	87.8	Confident	16 Å²	16	47.9 Å²	47.9	7%	0.07	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126.2	178	-52.7	-85.1	0	0	0	109	V149 L150 L170 Y177 A178 F195 L200	V149-F197 CarbonylContact C-O 3.51Å; V149-F197 VanDerWaalsContact CA-O 3.3Å; V149-F197 WeakPolarHBondContact CA-O 3.44Å; L150-F197 HydrophobicContact CB-CD2 4.44Å; L150-F197 HydrophobicContact CD2-CD2 4.32Å; L150-F197 PolarHBondContact N-O 3.09Å; L150-F197 PolarHBondContact O-N 3.04Å; L170-F197 HydrophobicContact CD2-CE2 3.51Å; L170-F197 HydrophobicContact CD2-CZ 3.67Å; Y177-F197 AromaticContact CD1-CD1 3.74Å; Y177-F197 HydrophobicContact CD1-CD1 3.74Å; Y177-F197 AromaticContact CD1-CE1 3.91Å; Y177-F197 HydrophobicContact CD1-CE1 3.91Å; Y177-F197 HydrophobicContact CD1-CG 4.42Å; Y177-F197 HydrophobicContact CG-CE1 4.43Å; A178-F197 HydrophobicContact CB-CZ 4.07Å; F195-F197 HydrophobicContact CB-CE2 3.57Å; F195-F197 HydrophobicContact CB-CZ 3.89Å; F197-L200 HydrophobicContact CB-CD1 3.9Å; F197-L200 HydrophobicContact CB-CD2 3.93Å; F197-L200 HydrophobicContact CB-CG 3.9Å
198	N	85.5	Confident	88.8	Confident	53 Å²	53	42.4 Å²	42.4	28%	0.283	22%	0.221	S	C	.	.			trans	-115.9	157.7	179	-70.6	-77.6	0	0	0	109.4	V149 E196 L200 R557	V149-N198 WeakPolarHBondContact CG1-OD1 3.38Å; V149-N198 WeakPolarHBondContact CG2-OD1 3.25Å; E196-N198 WeakPolarHBondContact CG-ND2 3.47Å; E196-N198 PolarHBondContact OE1-ND2 3.37Å; N198-L200 VanDerWaalsContact C-N 3.31Å; N198-L200 PolarHBondContact O-N 3.24Å; N198-R557 PolarHBondContact OD1-NH1 3.31Å; N198-R557 PolarHBondContact OD1-NH2 2.99Å
199	N	81.3	Confident	89.2	Confident	76 Å²	76	41.6 Å²	41.6	41%	0.406	21%	0.214	S	C	.	.	S	Bend	trans	55.5	39.4	-175.7	-58.1	-98.8	0	0	0	113.5	D147 N148	D147-N199 WeakPolarHBondContact OD1-CA 3.49Å; D147-N199 PolarHBondContact OD1-N 2.84Å; N148-N199 PolarHBondContact O-N 3.42Å
200	L	85.2	Confident	89.4	Confident	11 Å²	11	41.6 Å²	41.6	6%	0.058	21%	0.214	C	C	.	.			trans	-70.1	150.4	175.7	-74.7	176.6	0	0	0	112.3	N148 L150 L172 Y177 F197 N198 F276	N148-L200 HydrophobicContact CB-CB 3.88Å; N148-L200 WeakPolarHBondContact CB-O 3.33Å; N148-L200 PolarHBondContact ND2-O 3.39Å; N148-L200 WeakPolarHBondContact O-CB 3.22Å; N148-L200 PolarHBondContact O-N 3.08Å; L150-L200 HydrophobicContact CB-CD1 3.65Å; L172-L200 HydrophobicContact CD1-CD1 3.82Å; L172-L200 HydrophobicContact CD1-CD2 3.83Å; Y177-L200 HydrophobicContact CD1-CD2 4.22Å; Y177-L200 HydrophobicContact CE1-CD2 3.45Å; Y177-L200 VanDerWaalsContact CE1-CD2 3.45Å; F197-L200 HydrophobicContact CB-CD1 3.9Å; F197-L200 HydrophobicContact CB-CD2 3.93Å; F197-L200 HydrophobicContact CB-CG 3.9Å; N198-L200 VanDerWaalsContact C-N 3.31Å; N198-L200 PolarHBondContact O-N 3.24Å; L200-F276 HydrophobicContact CD1-CE2 4.24Å
201	P	84.3	Confident	89.5	Confident	60 Å²	60	39.3 Å²	39.3	39%	0.39	20%	0.203	S	C	.	.			trans	-65.9	178	164.5	31.6	-36.1	0	0	0	111.1	V203	P201-V203 VanDerWaalsContact C-N 3.35Å; P201-V203 HydrophobicContact CG-CG2 4.41Å; P201-V203 PolarHBondContact O-N 3.03Å
202	A	84.9	Confident	89.5	Confident	91 Å²	91	42.1 Å²	42.1	75%	0.752	22%	0.215	S	C	*	.			trans	-71.8	83.6	177.3	0	0	0	0	0	112.1
203	V	89.1	Confident	89.4	Confident	17 Å²	17	42.9 Å²	42.9	10%	0.103	22%	0.215	C	C	.	.			trans	-76.8	140.1	178.7	-176.1	0	0	0	0	111.5	L172 D173 P201 I233	L172-V203 HydrophobicContact CB-CG1 3.87Å; L172-V203 HydrophobicContact CB-CG2 4.13Å; L172-V203 HydrophobicContact CD1-CG2 4.36Å; L172-V203 HydrophobicContact CD2-CG1 4.39Å; D173-V203 WeakPolarHBondContact OD2-CA 3.34Å; P201-V203 VanDerWaalsContact C-N 3.35Å; P201-V203 HydrophobicContact CG-CG2 4.41Å; P201-V203 PolarHBondContact O-N 3.03Å; V203-I233 HydrophobicContact CB-CG1 4.17Å; V203-I233 HydrophobicContact CG1-CD1 4.09Å; V203-I233 HydrophobicContact CG1-CG1 3.77Å
204	R	91.8	Very high	88.8	Confident	198 Å²	198	44.3 Å²	44.3	75%	0.747	22%	0.224	S	C	*	.			trans	-104	-37.7	176.3	-58.4	-178.9	-177.8	-170.5	0.4	112.8	D173 I233	D173-R204 PolarHBondContact OD2-N 3.48Å; R204-I233 PolarHBondContact O-N 3.23Å
205	N	93.5	Very high	87.7	Confident	52 Å²	52	46.2 Å²	46.2	28%	0.278	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	128.3	-176.6	-52.3	-91.8	0	0	0	113.2	D173	D173-N205 PolarHBondContact N-O 2.84Å; D173-N205 WeakPolarHBondContact OD1-CB 3.32Å; D173-N205 PolarHBondContact OD1-N 3.2Å; D173-N205 PolarHBondContact OD1-ND2 2.87Å
206	L	94.9	Very high	86.5	Confident	1 Å²	1	53 Å²	53	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127	162.1	161.9	61.9	0	0	0	108.9	L152 L170 L172 L208 I231 I233 I236	L152-L206 HydrophobicContact CD1-CD2 4.38Å; L152-L206 HydrophobicContact CD2-CD1 3.99Å; L152-L206 HydrophobicContact CD2-CD2 4.39Å; L170-L206 HydrophobicContact CD1-CD1 3.19Å; L172-L206 HydrophobicContact CD2-CB 4.28Å; L172-L206 HydrophobicContact CD2-CD1 3.86Å; L206-L208 HydrophobicContact CD1-CD2 4.42Å; L206-I231 HydrophobicContact CB-CB 4.22Å; L206-I231 HydrophobicContact CD2-CB 4.31Å; L206-I231 HydrophobicContact CD2-CD1 4.06Å; L206-I231 HydrophobicContact CG-CB 4.32Å; L206-I231 PolarHBondContact N-O 2.94Å; L206-I231 PolarHBondContact O-N 3.36Å; L206-I233 HydrophobicContact CB-CD1 3.93Å; L206-I236 HydrophobicContact CD2-CD1 3.91Å
207	R	94.6	Very high	85	Confident	39 Å²	39	58.6 Å²	58.6	15%	0.147	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.1	175.5	-89.7	178	-83.4	157.5	-5.7	112.3	C171 D174 L228 V229 S230	C171-R207 HydrophobicContact CB-CB 4.45Å; C171-R207 PolarHBondContact N-O 2.98Å; C171-R207 PolarHBondContact O-N 3.42Å; C171-R207 VanDerWaalsContact O-O 3.13Å; D174-R207 VanDerWaalsContact CG-NH2 3.28Å; D174-R207 IonicContact OD1-CZ 2.83Å; D174-R207 IonicContact OD1-NH1 2.67Å; D174-R207 PolarHBondContact OD1-NH1 3.47Å; D174-R207 IonicContact OD1-NH2 2.72Å; D174-R207 IonicContact OD2-CZ 2.66Å; D174-R207 IonicContact OD2-NH1 3.61Å; D174-R207 PolarHBondContact OD2-NH1 2.87Å; D174-R207 IonicContact OD2-NH2 3.53Å; D174-R207 PolarHBondContact OD2-NH2 3.14Å; R207-L228 HydrophobicContact CG-CD1 4.48Å; R207-V229 CarbonylContact C-O 3.54Å; R207-V229 VanDerWaalsContact CA-O 3.27Å; R207-V229 WeakPolarHBondContact CA-O 3.5Å; R207-S230 WeakPolarHBondContact CG-OG 3.49Å
208	L	95.1	Very high	83.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	115.5	171.8	-62.6	-171.6	0	0	0	110	L152 I154 E169 L170 L206 L228 V229 L270 L272	L152-L208 HydrophobicContact CD2-CD2 4.42Å; I154-L208 HydrophobicContact CD1-CD1 3.84Å; I154-L208 HydrophobicContact CD1-CD2 3.74Å; I154-L208 HydrophobicContact CD1-CG 4.48Å; I154-L208 HydrophobicContact CG1-CD1 3.93Å; E169-L208 CarbonylContact O-C 3.6Å; E169-L208 WeakPolarHBondContact O-CA 3.31Å; L170-L208 HydrophobicContact CB-CD2 3.79Å; L170-L208 HydrophobicContact CD1-CD2 3.59Å; L170-L208 HydrophobicContact CG-CD2 4.26Å; L206-L208 HydrophobicContact CD1-CD2 4.42Å; L208-L228 CarbonylContact O-C 3.54Å; L208-L228 WeakPolarHBondContact O-CA 3.37Å; L208-L228 WeakPolarHBondContact O-CB 3.49Å; L208-V229 HydrophobicContact CB-CB 4.47Å; L208-V229 PolarHBondContact N-O 3.13Å; L208-V229 PolarHBondContact O-N 2.78Å; L208-L270 HydrophobicContact CB-CD1 4.4Å; L208-L270 HydrophobicContact CD1-CD1 4.48Å; L208-L272 HydrophobicContact CD1-CD1 3.52Å; L208-L272 HydrophobicContact CD1-CD2 3.35Å; L208-L272 HydrophobicContact CD1-CG 4.08Å; L208-L272 HydrophobicContact CG-CD1 4.41Å
209	H	93.1	Very high	82	Confident	30 Å²	30	74 Å²	74	14%	0.139	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	117.5	177.6	-71.7	-114.1	0	0	0	109.4	C168 E169 Y211 Y225	C168-H209 CarbonylContact C-O 3.52Å; C168-H209 WeakPolarHBondContact CA-O 3.33Å; E169-H209 HydrophobicContact CB-CB 4.26Å; E169-H209 PolarHBondContact N-O 2.93Å; E169-H209 PolarHBondContact O-N 2.73Å; H209-Y211 HydrophobicContact CB-CD2 4.48Å; H209-Y211 HydrophobicContact CB-CE2 3.66Å; H209-Y211 VanDerWaalsContact O-CD2 3.31Å; H209-Y211 WeakPolarHBondContact O-CD2 3.33Å; H209-Y225 HydrophobicContact CB-CE2 3.9Å; H209-Y225 AromaticContact ND1-CE2 3.63Å; H209-Y225 AromaticContact ND1-CZ 3.89Å
210	L	93.1	Very high	80.7	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	126.5	-174.3	-177.5	61.4	0	0	0	111.2	L160 W191 L226 G227 V248 A268	L160-L210 HydrophobicContact CD1-CD2 4.27Å; L160-L210 HydrophobicContact CD2-CD2 3.83Å; W191-L210 HydrophobicContact CH2-CD1 3.96Å; W191-L210 HydrophobicContact CZ2-CD1 4.39Å; L210-L226 HydrophobicContact CD2-CD1 4.32Å; L210-L226 HydrophobicContact CG-CD1 4.09Å; L210-L226 WeakPolarHBondContact O-CB 3.48Å; L210-L226 PolarHBondContact O-N 3.27Å; L210-G227 PolarHBondContact N-O 3.17Å; L210-V248 HydrophobicContact CB-CG1 4.41Å; L210-V248 HydrophobicContact CD2-CG1 4.26Å; L210-V248 HydrophobicContact CD2-CG2 3.86Å; L210-A268 HydrophobicContact CD2-CB 4.43Å
211	Y	91.2	Very high	79.4	Confident	44 Å²	44	84.5 Å²	84.5	17%	0.173	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	152.2	-178.8	-65	-97	0	0	0	112.1	Y166 Y167 E169 H209 Y225	Y166-Y211 VanDerWaalsContact CA-O 3.27Å; Y166-Y211 WeakPolarHBondContact CA-O 3.5Å; Y166-Y211 WeakPolarHBondContact CD1-O 3.28Å; Y167-Y211 HydrophobicContact CD2-CD2 4.12Å; Y167-Y211 HydrophobicContact CD2-CG 4.42Å; Y167-Y211 AromaticContact CE2-CD2 3.52Å; Y167-Y211 HydrophobicContact CE2-CD2 3.52Å; Y167-Y211 HydrophobicContact CE2-CE2 4.34Å; Y167-Y211 AromaticContact CE2-CG 3.65Å; Y167-Y211 HydrophobicContact CE2-CG 3.65Å; Y167-Y211 VanDerWaalsContact CZ-CB 3.4Å; Y167-Y211 AromaticContact CZ-CG 3.71Å; Y167-Y211 PolarHBondContact N-O 2.86Å; Y167-Y211 PolarHBondContact O-N 2.65Å; E169-Y211 HydrophobicContact CB-CE2 4.03Å; E169-Y211 VanDerWaalsContact CD-CE2 3.47Å; E169-Y211 HydrophobicContact CG-CD2 4.22Å; E169-Y211 HydrophobicContact CG-CE2 3.88Å; E169-Y211 VanDerWaalsContact OE2-CE2 3.24Å; E169-Y211 WeakPolarHBondContact OE2-CE2 3.48Å; E169-Y211 PolarHBondContact OE2-OH 3.23Å; H209-Y211 HydrophobicContact CB-CD2 4.48Å; H209-Y211 HydrophobicContact CB-CE2 3.66Å; H209-Y211 VanDerWaalsContact O-CD2 3.31Å; H209-Y211 WeakPolarHBondContact O-CD2 3.33Å; Y211-Y225 HydrophobicContact CD1-CD2 4.21Å; Y211-Y225 AromaticContact CE1-CD2 3.84Å; Y211-Y225 HydrophobicContact CE1-CD2 3.84Å; Y211-Y225 HydrophobicContact CE1-CG 4.23Å; Y211-Y225 HydrophobicContact CE2-CD2 4.2Å; Y211-Y225 AromaticContact CZ-CD2 3.82Å
212	K	90.1	Very high	78.8	Confident	60 Å²	60	87.7 Å²	87.7	26%	0.261	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.3	168.5	169.1	-176.3	156.8	-157.9	0	108.6	K164 R165 Y166 T224 L226	K164-K212 HydrophobicContact CB-CG 4.31Å; K164-K212 HydrophobicContact CG-CD 4.44Å; R165-K212 WeakPolarHBondContact O-CA 3.18Å; Y166-K212 HydrophobicContact CD1-CB 3.98Å; Y166-K212 HydrophobicContact CE1-CB 3.67Å; Y166-K212 HydrophobicContact CE1-CD 4.4Å; Y166-K212 HydrophobicContact CE1-CG 4.01Å; K212-T224 PolarHBondContact N-O 2.85Å; K212-T224 PolarHBondContact O-N 3.29Å; K212-L226 HydrophobicContact CB-CD1 4.17Å; K212-L226 HydrophobicContact CB-CD2 3.96Å; K212-L226 HydrophobicContact CB-CG 4.29Å; K212-L226 HydrophobicContact CD-CD2 4.47Å
213	E	85.9	Confident	78.6	Confident	29 Å²	29	85.2 Å²	85.2	14%	0.136	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-66.8	139.3	177.9	-160	-173.1	180	0	0	110.4	R165 S182	R165-E213 HydrophobicContact CB-CB 4.15Å; R165-E213 WeakPolarHBondContact CD-OE2 2.92Å; R165-E213 IonicContact NE-OE2 3.3Å; R165-E213 PolarHBondContact O-N 2.79Å; S182-E213 WeakPolarHBondContact CB-OE2 3.37Å; S182-E213 PolarHBondContact OG-OE2 2.76Å
214	T	78.3	Confident	78.6	Confident	30 Å²	30	87.3 Å²	87.3	18%	0.184	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-81.4	152.6	171.6	39.1	0	0	0	0	111	K216 E221 K222	T214-K216 PolarHBondContact O-N 2.71Å; T214-E221 WeakPolarHBondContact CB-O 3.43Å; T214-E221 HydrophobicContact CG2-CB 3.97Å; T214-E221 HydrophobicContact CG2-CG 3.96Å; T214-E221 WeakPolarHBondContact CG2-O 3.3Å; T214-E221 PolarHBondContact OG1-O 3.43Å; T214-K222 VanDerWaalsContact CG2-O 3.26Å; T214-K222 WeakPolarHBondContact CG2-O 3.47Å
215	D	66.3	Low	78.4	Confident	89 Å²	89	81.3 Å²	81.3	48%	0.476	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-63.7	130	-178.3	-171.4	-39	0	0	0	110.3	K217 R218	D215-K217 PolarHBondContact O-N 2.97Å; D215-K217 VanDerWaalsContact OD1-CB 3.29Å; D215-K217 WeakPolarHBondContact OD1-CB 3.25Å; D215-K217 WeakPolarHBondContact OD1-CG 3.45Å; D215-K217 PolarHBondContact OD1-N 2.92Å; D215-R218 WeakPolarHBondContact O-CA 3.2Å; D215-R218 PolarHBondContact O-N 3.29Å
216	K	61.9	Low	78.2	Confident	145 Å²	145	79.3 Å²	79.3	63%	0.63	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.7	178.7	-64	-177.2	180	-179.7	0	113.3	T214 R218 R219	T214-K216 PolarHBondContact O-N 2.71Å; K216-R218 VanDerWaalsContact C-N 3.33Å; K216-R219 WeakPolarHBondContact O-CG 3.31Å
217	K	57.9	Low	78	Confident	188 Å²	188	79.3 Å²	79.3	82%	0.817	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-20.1	171.1	-65	172.5	-179.9	174.6	0	113.5	D215	D215-K217 PolarHBondContact O-N 2.97Å; D215-K217 VanDerWaalsContact OD1-CB 3.29Å; D215-K217 WeakPolarHBondContact OD1-CB 3.25Å; D215-K217 WeakPolarHBondContact OD1-CG 3.45Å; D215-K217 PolarHBondContact OD1-N 2.92Å
218	R	57.7	Low	77.9	Confident	159 Å²	159	78.7 Å²	78.7	60%	0.6	35%	0.35	S	S	*	.			trans	-109.6	58	178.9	-68.2	-167.6	171	-163.1	-4.2	112.4	D215 K216 K220 E221	D215-R218 WeakPolarHBondContact O-CA 3.2Å; D215-R218 PolarHBondContact O-N 3.29Å; K216-R218 VanDerWaalsContact C-N 3.33Å; R218-K220 PolarHBondContact O-N 2.81Å; R218-E221 HydrophobicContact CB-CB 4.46Å; R218-E221 WeakPolarHBondContact CD-OE2 3.38Å; R218-E221 IonicContact CZ-OE2 3.18Å; R218-E221 IonicContact NE-OE2 3.62Å; R218-E221 IonicContact NH1-OE1 2.86Å; R218-E221 IonicContact NH1-OE2 3.61Å; R218-E221 PolarHBondContact NH1-OE2 2.84Å; R218-E221 PolarHBondContact O-N 3.26Å
219	R	52.9	Low	77.8	Confident	233 Å²	233	78.8 Å²	78.8	88%	0.879	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	2.7	-175.9	-70.3	-172.1	169.5	178.8	-5.1	118.5	K216	K216-R219 WeakPolarHBondContact O-CG 3.31Å
220	K	53.8	Low	77.9	Confident	213 Å²	213	79.9 Å²	79.9	93%	0.926	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-10.8	174.3	-83.9	-168.9	172.2	-173.7	0	114.5	R218	R218-K220 PolarHBondContact O-N 2.81Å
221	E	58.3	Low	78	Confident	96 Å²	96	80 Å²	80	45%	0.449	36%	0.362	S	S	.	.			trans	-93.1	114.4	-172.1	-153.2	165.4	-172.8	0	0	109.5	T214 R218	T214-E221 WeakPolarHBondContact CB-O 3.43Å; T214-E221 HydrophobicContact CG2-CB 3.97Å; T214-E221 HydrophobicContact CG2-CG 3.96Å; T214-E221 WeakPolarHBondContact CG2-O 3.3Å; T214-E221 PolarHBondContact OG1-O 3.43Å; R218-E221 HydrophobicContact CB-CB 4.46Å; R218-E221 WeakPolarHBondContact CD-OE2 3.38Å; R218-E221 IonicContact CZ-OE2 3.18Å; R218-E221 IonicContact NE-OE2 3.62Å; R218-E221 IonicContact NH1-OE1 2.86Å; R218-E221 IonicContact NH1-OE2 3.61Å; R218-E221 PolarHBondContact NH1-OE2 2.84Å; R218-E221 PolarHBondContact O-N 3.26Å
222	K	70.4	Confident	78.1	Confident	126 Å²	126	80.8 Å²	80.8	55%	0.548	37%	0.373	S	S	.	.			trans	-61.7	148.8	176.2	-74.1	-164.6	-176.8	-170.2	0	110.5	A52 D53 T214 T224	A52-K222 HydrophobicContact CB-CD 4Å; A52-K222 VanDerWaalsContact CB-CE 3.48Å; A52-K222 HydrophobicContact CB-CG 4.33Å; D53-K222 IonicContact OD1-NZ 2.69Å; D53-K222 PolarHBondContact OD1-NZ 2.91Å; T214-K222 VanDerWaalsContact CG2-O 3.26Å; T214-K222 WeakPolarHBondContact CG2-O 3.47Å; K222-T224 PolarHBondContact O-N 3.42Å
223	S	82.1	Confident	78.3	Confident	39 Å²	39	78.2 Å²	78.2	27%	0.273	36%	0.362	S	S	.	.			trans	-48.3	137.3	172.1	-54.6	0	0	0	0	111.8	Y167 Y225	Y167-S223 WeakPolarHBondContact OH-CB 3.47Å; Y167-S223 PolarHBondContact OH-OG 2.98Å; S223-Y225 PolarHBondContact O-N 3.21Å
224	T	87.1	Confident	78.7	Confident	61 Å²	61	81.7 Å²	81.7	37%	0.374	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	112.1	178.9	-42.2	0	0	0	0	109.8	K212 K222 L226	K212-T224 PolarHBondContact N-O 2.85Å; K212-T224 PolarHBondContact O-N 3.29Å; K222-T224 PolarHBondContact O-N 3.42Å; T224-L226 HydrophobicContact CG2-CD2 4.48Å
225	Y	88.8	Confident	79.3	Confident	72 Å²	72	83.3 Å²	83.3	28%	0.282	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	139.5	169.5	177.9	-117	0	0	0	110.8	H209 Y211 S223 G227 L228 P251	H209-Y225 HydrophobicContact CB-CE2 3.9Å; H209-Y225 AromaticContact ND1-CE2 3.63Å; H209-Y225 AromaticContact ND1-CZ 3.89Å; Y211-Y225 HydrophobicContact CD1-CD2 4.21Å; Y211-Y225 AromaticContact CE1-CD2 3.84Å; Y211-Y225 HydrophobicContact CE1-CD2 3.84Å; Y211-Y225 HydrophobicContact CE1-CG 4.23Å; Y211-Y225 HydrophobicContact CE2-CD2 4.2Å; Y211-Y225 AromaticContact CZ-CD2 3.82Å; S223-Y225 PolarHBondContact O-N 3.21Å; Y225-G227 WeakPolarHBondContact CE2-O 3.44Å; Y225-G227 VanDerWaalsContact CZ-C 3.48Å; Y225-L228 WeakPolarHBondContact OH-CB 3.44Å; Y225-L228 PolarHBondContact OH-N 3Å; Y225-P251 HydrophobicContact CE1-CG 4.42Å
226	L	88.4	Confident	80.6	Confident	11 Å²	11	79.1 Å²	79.1	6%	0.058	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	-41.3	-176.1	-52.7	-178.2	0	0	0	112.1	L160 Y166 L210 K212 T224 Q250 I266	L160-L226 HydrophobicContact CD2-CD1 3.69Å; Y166-L226 HydrophobicContact CD1-CD1 3.74Å; Y166-L226 HydrophobicContact CE1-CD1 3.53Å; L210-L226 HydrophobicContact CD2-CD1 4.32Å; L210-L226 HydrophobicContact CG-CD1 4.09Å; L210-L226 WeakPolarHBondContact O-CB 3.48Å; L210-L226 PolarHBondContact O-N 3.27Å; K212-L226 HydrophobicContact CB-CD1 4.17Å; K212-L226 HydrophobicContact CB-CD2 3.96Å; K212-L226 HydrophobicContact CB-CG 4.29Å; K212-L226 HydrophobicContact CD-CD2 4.47Å; T224-L226 HydrophobicContact CG2-CD2 4.48Å; L226-Q250 VanDerWaalsContact O-CG 3.28Å; L226-Q250 WeakPolarHBondContact O-CG 3.43Å; L226-Q250 PolarHBondContact O-NE2 3.26Å; L226-I266 HydrophobicContact CB-CD1 3.95Å; L226-I266 HydrophobicContact CD2-CD1 4.02Å; L226-I266 HydrophobicContact CG-CD1 4.47Å
227	G	90.4	Very high	82	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.3	-174.4	-176.5	0	0	0	0	0	110.7	L210 Y225 I249	L210-G227 PolarHBondContact N-O 3.17Å; Y225-G227 WeakPolarHBondContact CE2-O 3.44Å; Y225-G227 VanDerWaalsContact CZ-C 3.48Å; G227-I249 CarbonylContact C-O 3.48Å; G227-I249 VanDerWaalsContact CA-O 3.24Å; G227-I249 WeakPolarHBondContact CA-O 3.34Å
228	L	92.7	Very high	83.3	Confident	27 Å²	27	68.4 Å²	68.4	14%	0.141	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.2	178.5	64.1	81.7	0	0	0	112.9	R207 L208 Y225 I249 P251	R207-L228 HydrophobicContact CG-CD1 4.48Å; L208-L228 CarbonylContact O-C 3.54Å; L208-L228 WeakPolarHBondContact O-CA 3.37Å; L208-L228 WeakPolarHBondContact O-CB 3.49Å; Y225-L228 WeakPolarHBondContact OH-CB 3.44Å; Y225-L228 PolarHBondContact OH-N 3Å; L228-I249 PolarHBondContact N-O 3.2Å; L228-I249 PolarHBondContact O-N 3.42Å; L228-P251 HydrophobicContact CD2-CG 4.44Å
229	V	94.4	Very high	84.3	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.018	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139	157.5	163.1	0	0	0	0	107.6	R207 L208 I231 Y246 P247 V248 L270 L272	R207-V229 CarbonylContact C-O 3.54Å; R207-V229 VanDerWaalsContact CA-O 3.27Å; R207-V229 WeakPolarHBondContact CA-O 3.5Å; L208-V229 HydrophobicContact CB-CB 4.47Å; L208-V229 PolarHBondContact N-O 3.13Å; L208-V229 PolarHBondContact O-N 2.78Å; V229-I231 HydrophobicContact CG1-CD1 3.97Å; V229-I231 HydrophobicContact CG1-CG1 3.84Å; V229-Y246 HydrophobicContact CG1-CD1 4.26Å; V229-Y246 HydrophobicContact CG1-CG 3.9Å; V229-P247 WeakPolarHBondContact CG2-O 3.4Å; V229-V248 HydrophobicContact CG2-CG2 4.26Å; V229-L270 HydrophobicContact CB-CD1 4.45Å; V229-L270 HydrophobicContact CG2-CB 4.26Å; V229-L270 HydrophobicContact CG2-CD1 3.9Å; V229-L272 HydrophobicContact CG1-CD1 3.96Å
230	S	93.9	Very high	85.9	Confident	53 Å²	53	59.1 Å²	59.1	37%	0.371	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.8	174.1	-165.3	0	0	0	0	109.7	R207	R207-S230 WeakPolarHBondContact CG-OG 3.49Å
231	I	94.8	Very high	87.6	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	115.6	-175.5	-61.9	172.5	0	0	0	107.5	L206 V229 I233 I236 Y246 L272	L206-I231 HydrophobicContact CB-CB 4.22Å; L206-I231 HydrophobicContact CD2-CB 4.31Å; L206-I231 HydrophobicContact CD2-CD1 4.06Å; L206-I231 HydrophobicContact CG-CB 4.32Å; L206-I231 PolarHBondContact N-O 2.94Å; L206-I231 PolarHBondContact O-N 3.36Å; V229-I231 HydrophobicContact CG1-CD1 3.97Å; V229-I231 HydrophobicContact CG1-CG1 3.84Å; I231-I233 PolarHBondContact O-N 2.92Å; I231-I236 HydrophobicContact CG2-CD1 4.43Å; I231-I236 HydrophobicContact CG2-CG1 4.45Å; I231-I236 HydrophobicContact CG2-CG2 3.69Å; I231-Y246 HydrophobicContact CD1-CD1 4.06Å; I231-Y246 HydrophobicContact CD1-CD2 4.02Å; I231-Y246 HydrophobicContact CD1-CE1 3.75Å; I231-Y246 HydrophobicContact CD1-CE2 3.68Å; I231-Y246 HydrophobicContact CD1-CG 4.19Å; I231-Y246 HydrophobicContact CG1-CD1 3.93Å; I231-Y246 HydrophobicContact CG1-CE1 3.68Å; I231-Y246 HydrophobicContact CG1-CG 4.47Å; I231-L272 HydrophobicContact CD1-CD1 3.8Å
232	P	94.6	Very high	89.4	Confident	60 Å²	60	49.8 Å²	49.8	39%	0.39	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	132.1	169.1	-20.3	33.2	0	0	0	109.5	S234 S235	P232-S234 PolarHBondContact O-N 2.72Å; P232-S234 VanDerWaalsContact O-N 3.14Å; P232-S235 PolarHBondContact O-N 2.76Å; P232-S235 PolarHBondContact O-OG 3.05Å
233	I	94.1	Very high	90.6	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.031	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-56.9	-34.5	-179.4	-70.2	-60.8	0	0	0	111.2	V203 R204 L206 I231 S235 I236 T237 F276	V203-I233 HydrophobicContact CB-CG1 4.17Å; V203-I233 HydrophobicContact CG1-CD1 4.09Å; V203-I233 HydrophobicContact CG1-CG1 3.77Å; R204-I233 PolarHBondContact O-N 3.23Å; L206-I233 HydrophobicContact CB-CD1 3.93Å; I231-I233 PolarHBondContact O-N 2.92Å; I233-S235 PolarHBondContact O-N 2.74Å; I233-S235 VanDerWaalsContact O-N 3.13Å; I233-I236 HydrophobicContact CD1-CD1 4.09Å; I233-I236 HydrophobicContact CD1-CG1 4.5Å; I233-I236 CarbonylContact O-C 3.46Å; I233-I236 VanDerWaalsContact O-CG1 3.27Å; I233-I236 WeakPolarHBondContact O-CG1 3.4Å; I233-I236 PolarHBondContact O-N 3Å; I233-T237 PolarHBondContact O-N 2.88Å; I233-T237 PolarHBondContact O-OG1 2.86Å; I233-F276 HydrophobicContact CD1-CD2 4.1Å; I233-F276 HydrophobicContact CD1-CE2 4.47Å; I233-F276 HydrophobicContact CD1-CG 4.5Å; I233-F276 HydrophobicContact CG2-CB 4.02Å; I233-F276 HydrophobicContact CG2-CD1 3.25Å; I233-F276 HydrophobicContact CG2-CD2 3.88Å; I233-F276 HydrophobicContact CG2-CE1 3.5Å; I233-F276 VanDerWaalsContact CG2-CE1 3.5Å; I233-F276 HydrophobicContact CG2-CE2 4.09Å; I233-F276 HydrophobicContact CG2-CG 3.45Å; I233-F276 VanDerWaalsContact CG2-CG 3.45Å; I233-F276 HydrophobicContact CG2-CZ 3.91Å
234	S	93.3	Very high	91.2	Very high	102 Å²	102	50.6 Å²	50.6	71%	0.713	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-58	-22.9	175.7	54	0	0	0	0	115.4	P232 I236	P232-S234 PolarHBondContact O-N 2.72Å; P232-S234 VanDerWaalsContact O-N 3.14Å; S234-I236 VanDerWaalsContact C-N 3.34Å
235	S	92.8	Very high	91.6	Very high	64 Å²	64	51.7 Å²	51.7	45%	0.448	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-86.6	-3.4	175.1	70.2	0	0	0	0	113.8	P232 I233	P232-S235 PolarHBondContact O-N 2.76Å; P232-S235 PolarHBondContact O-OG 3.05Å; I233-S235 PolarHBondContact O-N 2.74Å; I233-S235 VanDerWaalsContact O-N 3.13Å
236	I	93.2	Very high	91.9	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	6	178.9	64.8	164.6	0	0	0	113	L150 L206 I231 I233 S234 V242 S274 F276	L150-I236 HydrophobicContact CD1-CD1 3.93Å; L206-I236 HydrophobicContact CD2-CD1 3.91Å; I231-I236 HydrophobicContact CG2-CD1 4.43Å; I231-I236 HydrophobicContact CG2-CG1 4.45Å; I231-I236 HydrophobicContact CG2-CG2 3.69Å; I233-I236 HydrophobicContact CD1-CD1 4.09Å; I233-I236 HydrophobicContact CD1-CG1 4.5Å; I233-I236 CarbonylContact O-C 3.46Å; I233-I236 VanDerWaalsContact O-CG1 3.27Å; I233-I236 WeakPolarHBondContact O-CG1 3.4Å; I233-I236 PolarHBondContact O-N 3Å; S234-I236 VanDerWaalsContact C-N 3.34Å; I236-V242 HydrophobicContact CG2-CB 4.26Å; I236-S274 WeakPolarHBondContact CG2-OG 3.14Å; I236-F276 HydrophobicContact CD1-CB 4.24Å; I236-F276 HydrophobicContact CG1-CB 4.07Å; I236-F276 PolarHBondContact O-N 3.08Å
237	T	91.6	Very high	92.1	Very high	77 Å²	77	53 Å²	53	47%	0.472	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-73.1	123.4	175.3	-62.7	0	0	0	0	111.1	I233 F276	I233-T237 PolarHBondContact O-N 2.88Å; I233-T237 PolarHBondContact O-OG1 2.86Å; T237-F276 CarbonylContact C-O 3.56Å; T237-F276 VanDerWaalsContact CA-O 3.32Å; T237-F276 WeakPolarHBondContact CA-O 3.43Å
238	G	84	Confident	92.2	Very high	31 Å²	31	53.6 Å²	53.6	32%	0.32	30%	0.298	S	S	.	.	S	Bend	trans	159.2	-172.4	172.6	0	0	0	0	0	114.6	R275 F276 Q277	G238-R275 WeakPolarHBondContact O-CG 3.42Å; G238-F276 PolarHBondContact N-O 2.94Å; G238-Q277 WeakPolarHBondContact O-CG 3.37Å
239	R	79.3	Confident	92	Very high	60 Å²	60	56.3 Å²	56.3	23%	0.226	31%	0.312	C	S	.	.	S	Bend	trans	-89.6	-15.4	175.4	-169.4	171.5	170.3	-143.5	-7.1	113.2	R275 E316 E568	R239-R275 WeakPolarHBondContact O-CD 3.27Å; R239-R275 PolarHBondContact O-NE 3.45Å; R239-R275 PolarHBondContact O-NH1 3.24Å; R239-E316 IonicContact CZ-OE2 3.58Å; R239-E316 IonicContact NE-OE2 2.78Å; R239-E316 PolarHBondContact NE-OE2 3.17Å; R239-E316 IonicContact NH2-OE2 3.76Å; R239-E316 PolarHBondContact NH2-OE2 3.34Å; R239-E568 IonicContact CZ-OE1 2.74Å; R239-E568 IonicContact CZ-OE2 2.78Å; R239-E568 IonicContact NH1-OE1 3.21Å; R239-E568 PolarHBondContact NH1-OE1 3.31Å; R239-E568 IonicContact NH1-OE2 3.06Å; R239-E568 PolarHBondContact NH1-OE2 2.85Å
240	Q	85.8	Confident	91.3	Very high	137 Å²	137	58.4 Å²	58.4	64%	0.64	32%	0.322	S	S	*	.	S	Bend	trans	-97.6	157.2	174.8	-61.6	-55.4	-32.1	0	0	111.6
241	F	90.8	Very high	89.8	Confident	65 Å²	65	58.6 Å²	58.6	29%	0.285	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-85.4	129.6	172.2	-79.6	-79.1	0	0	0	110.7	K151 W153 K273 R275	K151-F241 HydrophobicContact CB-CE1 3.95Å; K151-F241 HydrophobicContact CB-CZ 4.11Å; W153-F241 HydrophobicContact CE3-CE1 4.18Å; W153-F241 HydrophobicContact CH2-CE1 4.25Å; W153-F241 HydrophobicContact CH2-CZ 4.07Å; W153-F241 HydrophobicContact CZ3-CD1 4.16Å; W153-F241 AromaticContact CZ3-CE1 3.4Å; W153-F241 HydrophobicContact CZ3-CE1 3.4Å; W153-F241 VanDerWaalsContact CZ3-CE1 3.4Å; W153-F241 AromaticContact CZ3-CZ 3.68Å; W153-F241 HydrophobicContact CZ3-CZ 3.68Å; F241-K273 HydrophobicContact CB-CD 4.41Å; F241-K273 HydrophobicContact CB-CG 3.96Å; F241-K273 HydrophobicContact CD1-CG 3.97Å; F241-K273 HydrophobicContact CG-CG 4.21Å; F241-R275 HydrophobicContact CD1-CB 3.4Å; F241-R275 VanDerWaalsContact CD1-CB 3.4Å; F241-R275 HydrophobicContact CE1-CB 3.29Å; F241-R275 HydrophobicContact CE1-CG 4.34Å; F241-R275 HydrophobicContact CE2-CB 4.46Å; F241-R275 HydrophobicContact CG-CB 4.03Å; F241-R275 HydrophobicContact CZ-CB 3.89Å; F241-R275 HydrophobicContact CZ-CG 4.49Å
242	V	94.8	Very high	88	Confident	47 Å²	47	62.2 Å²	62.2	29%	0.285	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117	169.1	-178.7	0	0	0	0	108	I236 K273 S274	I236-V242 HydrophobicContact CG2-CB 4.26Å; V242-K273 CarbonylContact O-C 3.46Å; V242-K273 WeakPolarHBondContact O-CA 3.46Å; V242-S274 PolarHBondContact N-O 3.39Å; V242-S274 PolarHBondContact O-N 3.4Å
243	E	95.9	Very high	85.9	Confident	78 Å²	78	63.5 Å²	63.5	36%	0.364	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.8	173.7	-174	174.9	146.4	0	0	110.4	I155 R271 L272 K273	I155-E243 HydrophobicContact CD1-CG 4.24Å; E243-R271 IonicContact OE1-CZ 2.92Å; E243-R271 IonicContact OE1-NE 3.59Å; E243-R271 PolarHBondContact OE1-NE 3.16Å; E243-R271 IonicContact OE1-NH2 2.69Å; E243-R271 PolarHBondContact OE1-NH2 3.07Å; E243-L272 VanDerWaalsContact CA-O 3.32Å; E243-L272 WeakPolarHBondContact CA-O 3.47Å; E243-K273 HydrophobicContact CB-CB 4Å; E243-K273 HydrophobicContact CB-CG 4.12Å; E243-K273 HydrophobicContact CG-CB 3.93Å; E243-K273 HydrophobicContact CG-CG 4.48Å
244	Q	95.4	Very high	83.8	Confident	105 Å²	105	69.9 Å²	69.9	49%	0.491	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	155.8	-172.3	-173.2	171.8	8	0	0	112.3	Y246 R271 L272	Q244-Y246 HydrophobicContact CB-CD2 4.41Å; Q244-Y246 HydrophobicContact CB-CE2 3.71Å; Q244-Y246 HydrophobicContact CG-CE2 4.31Å; Q244-Y246 WeakPolarHBondContact O-CD2 3.37Å; Q244-Y246 WeakPolarHBondContact O-CE2 3.36Å; Q244-R271 WeakPolarHBondContact O-CA 3.35Å; Q244-L272 PolarHBondContact N-O 2.9Å; Q244-L272 PolarHBondContact O-N 3Å
245	W	95.7	Very high	81.5	Confident	84 Å²	84	70.4 Å²	70.4	32%	0.318	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.7	167.1	-74.6	95	0	0	0	110.9	E156 R158 L270 R271	E156-W245 HydrophobicContact CG-CH2 3.65Å; E156-W245 HydrophobicContact CG-CZ2 4.15Å; E156-W245 HydrophobicContact CG-CZ3 4.35Å; E156-W245 WeakPolarHBondContact OE1-CZ2 3.42Å; R158-W245 HydrophobicContact CB-CH2 4.18Å; R158-W245 HydrophobicContact CB-CZ3 4.16Å; R158-W245 HydrophobicContact CG-CE3 4.34Å; R158-W245 HydrophobicContact CG-CH2 3.97Å; R158-W245 HydrophobicContact CG-CZ3 3.62Å; W245-L270 WeakPolarHBondContact CA-O 3.33Å; W245-R271 HydrophobicContact CD2-CB 3.78Å; W245-R271 HydrophobicContact CD2-CG 4.24Å; W245-R271 HydrophobicContact CE3-CB 3.78Å; W245-R271 HydrophobicContact CG-CB 4.47Å; W245-R271 HydrophobicContact CH2-CB 3.9Å; W245-R271 HydrophobicContact CZ2-CB 3.89Å; W245-R271 HydrophobicContact CZ2-CG 4.28Å; W245-R271 HydrophobicContact CZ3-CB 3.83Å
246	Y	94.6	Very high	79.1	Confident	24 Å²	24	75.7 Å²	75.7	9%	0.094	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.7	179	-62.3	-90.4	0	0	0	110.6	V229 I231 Q244 S269 L270 L272	V229-Y246 HydrophobicContact CG1-CD1 4.26Å; V229-Y246 HydrophobicContact CG1-CG 3.9Å; I231-Y246 HydrophobicContact CD1-CD1 4.06Å; I231-Y246 HydrophobicContact CD1-CD2 4.02Å; I231-Y246 HydrophobicContact CD1-CE1 3.75Å; I231-Y246 HydrophobicContact CD1-CE2 3.68Å; I231-Y246 HydrophobicContact CD1-CG 4.19Å; I231-Y246 HydrophobicContact CG1-CD1 3.93Å; I231-Y246 HydrophobicContact CG1-CE1 3.68Å; I231-Y246 HydrophobicContact CG1-CG 4.47Å; Q244-Y246 HydrophobicContact CB-CD2 4.41Å; Q244-Y246 HydrophobicContact CB-CE2 3.71Å; Q244-Y246 HydrophobicContact CG-CE2 4.31Å; Q244-Y246 WeakPolarHBondContact O-CD2 3.37Å; Q244-Y246 WeakPolarHBondContact O-CE2 3.36Å; Y246-S269 CarbonylContact O-C 3.53Å; Y246-S269 WeakPolarHBondContact O-CA 3.45Å; Y246-L270 PolarHBondContact N-O 2.98Å; Y246-L270 PolarHBondContact O-N 3.01Å; Y246-L272 HydrophobicContact CD2-CB 4.06Å; Y246-L272 HydrophobicContact CD2-CD1 3.74Å; Y246-L272 HydrophobicContact CD2-CG 4.05Å; Y246-L272 HydrophobicContact CE2-CB 4Å; Y246-L272 HydrophobicContact CE2-CD1 4.23Å; Y246-L272 HydrophobicContact CE2-CG 4.48Å; Y246-L272 HydrophobicContact CG-CD1 4.4Å
247	P	92.9	Very high	76.9	Confident	85 Å²	85	79.3 Å²	79.3	55%	0.552	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	141.6	177.1	30.6	-34.7	0	0	0	111.3	V229 I249	V229-P247 WeakPolarHBondContact CG2-O 3.4Å; P247-I249 PolarHBondContact O-N 3.25Å
248	V	91.9	Very high	74.4	Confident	14 Å²	14	80.4 Å²	80.4	9%	0.085	46%	0.455	C	S	.	.			trans	-83.3	111.3	178.7	179.3	0	0	0	0	109.8	L210 V229 A268 L270	L210-V248 HydrophobicContact CB-CG1 4.41Å; L210-V248 HydrophobicContact CD2-CG1 4.26Å; L210-V248 HydrophobicContact CD2-CG2 3.86Å; V229-V248 HydrophobicContact CG2-CG2 4.26Å; V248-A268 HydrophobicContact CB-CB 4.08Å; V248-A268 WeakPolarHBondContact CB-O 3.45Å; V248-A268 HydrophobicContact CG2-CB 3.93Å; V248-A268 WeakPolarHBondContact CG2-O 3.3Å; V248-A268 PolarHBondContact N-O 3.02Å; V248-L270 HydrophobicContact CG2-CD1 4.03Å; V248-L270 HydrophobicContact CG2-CG 4.16Å
249	I	88.2	Confident	72.1	Confident	83 Å²	83	82.4 Å²	82.4	43%	0.426	48%	0.476	S	S	.	.	B	Isolated β-bridge	trans	-90.7	125.9	-176.4	-55.5	175	0	0	0	109.6	G227 L228 P247 P251 L254	G227-I249 CarbonylContact C-O 3.48Å; G227-I249 VanDerWaalsContact CA-O 3.24Å; G227-I249 WeakPolarHBondContact CA-O 3.34Å; L228-I249 PolarHBondContact N-O 3.2Å; L228-I249 PolarHBondContact O-N 3.42Å; P247-I249 PolarHBondContact O-N 3.25Å; I249-P251 WeakPolarHBondContact O-CD 3.49Å; I249-L254 HydrophobicContact CG2-CD1 4.14Å
250	Q	80.6	Confident	70.5	Confident	48 Å²	48	87.3 Å²	87.3	22%	0.224	51%	0.513	C	S	.	.			trans	-94.5	116.5	174.8	-166.8	176.6	59.8	0	0	110.9	L226 S252 V253	L226-Q250 VanDerWaalsContact O-CG 3.28Å; L226-Q250 WeakPolarHBondContact O-CG 3.43Å; L226-Q250 PolarHBondContact O-NE2 3.26Å; Q250-S252 WeakPolarHBondContact CG-OG 3.47Å; Q250-S252 PolarHBondContact O-N 2.83Å; Q250-S252 PolarHBondContact OE1-OG 2.94Å; Q250-V253 HydrophobicContact CB-CG2 4.37Å; Q250-V253 PolarHBondContact O-N 2.89Å; Q250-V253 VanDerWaalsContact O-N 3.09Å
251	P	62.3	Low	68	Low	56 Å²	56	84.1 Å²	84.1	36%	0.364	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-58.8	-24.8	-172.6	-28.4	36.1	0	0	0	116	Y225 L228 I249 V253 L254 T255	Y225-P251 HydrophobicContact CE1-CG 4.42Å; L228-P251 HydrophobicContact CD2-CG 4.44Å; I249-P251 WeakPolarHBondContact O-CD 3.49Å; P251-V253 PolarHBondContact O-N 2.94Å; P251-L254 PolarHBondContact O-N 2.77Å; P251-T255 PolarHBondContact O-OG1 2.78Å
252	S	57.1	Low	65.5	Low	78 Å²	78	84.7 Å²	84.7	55%	0.545	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-67.8	-13.1	178.1	50.2	0	0	0	0	114.5	Q250	Q250-S252 WeakPolarHBondContact CG-OG 3.47Å; Q250-S252 PolarHBondContact O-N 2.83Å; Q250-S252 PolarHBondContact OE1-OG 2.94Å
253	V	50.8	Low	63	Low	87 Å²	87	85.4 Å²	85.4	53%	0.527	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-84.3	-24.2	176.8	-174.7	0	0	0	0	111.7	Q250 P251	Q250-V253 HydrophobicContact CB-CG2 4.37Å; Q250-V253 PolarHBondContact O-N 2.89Å; Q250-V253 VanDerWaalsContact O-N 3.09Å; P251-V253 PolarHBondContact O-N 2.94Å
254	L	48.9	Very low	60.8	Low	140 Å²	140	90.2 Å²	90.2	73%	0.733	58%	0.577	S	S	*	*	S	Bend	trans	-85.6	-8.4	-174.1	-67	172.2	0	0	0	114.6	I249 P251	I249-L254 HydrophobicContact CG2-CD1 4.14Å; P251-L254 PolarHBondContact O-N 2.77Å
255	T	45.5	Very low	58.9	Low	113 Å²	113	91.3 Å²	91.3	69%	0.693	59%	0.585	S	S	*	*	S	Bend	trans	-115.7	2.7	-166.9	38.7	0	0	0	0	115.4	P251	P251-T255 PolarHBondContact O-OG1 2.78Å
256	K	41.5	Very low	57.5	Low	176 Å²	176	89.1 Å²	89.1	77%	0.765	58%	0.579	S	S	*	*			trans	-141.5	103.6	172	-71.4	-165	175.9	-172.3	0	113.3
257	G	46.9	Very low	56.7	Low	78 Å²	78	92.9 Å²	92.9	80%	0.804	60%	0.601	S	S	*	*	S	Bend	trans	-67	147.4	145.1	0	0	0	0	0	109.7
258	A	39.6	Very low	56.6	Low	99 Å²	99	88.9 Å²	88.9	82%	0.818	58%	0.575	S	S	*	*	S	Bend	trans	64	125.6	-174.7	0	0	0	0	0	116.5
259	G	36.5	Very low	56.6	Low	74 Å²	74	88.9 Å²	88.9	76%	0.763	58%	0.576	S	S	*	*			trans	132.5	89.6	172.1	0	0	0	0	0	113.7	G261	G259-G261 PolarHBondContact O-N 2.7Å; G259-G261 VanDerWaalsContact O-N 3.08Å
260	V	44.9	Very low	56.9	Low	163 Å²	163	85 Å²	85	99%	0.988	56%	0.556	S	S	*	*			trans	-65	108	172.2	176.7	0	0	0	0	108.8
261	G	34.3	Very low	57.7	Low	70 Å²	70	86.6 Å²	86.6	72%	0.722	56%	0.56	S	S	*	*			trans	-158.1	34.7	-161.2	0	0	0	0	0	116.9	G259 G263	G259-G261 PolarHBondContact O-N 2.7Å; G259-G261 VanDerWaalsContact O-N 3.08Å; G261-G263 VanDerWaalsContact C-N 3.28Å; G261-G263 PolarHBondContact O-N 3.27Å
262	G	38.3	Very low	59.3	Low	76 Å²	76	84 Å²	84	78%	0.784	54%	0.543	S	S	*	.			trans	66.4	14.1	160.2	0	0	0	0	0	117.9	K264	G262-K264 PolarHBondContact O-N 2.88Å
263	G	40.9	Very low	61.2	Low	63 Å²	63	81.7 Å²	81.7	65%	0.649	52%	0.523	S	S	*	.			trans	-62.4	103.5	172.6	0	0	0	0	0	111.1	G261 I265	G261-G263 VanDerWaalsContact C-N 3.28Å; G261-G263 PolarHBondContact O-N 3.27Å; G263-I265 PolarHBondContact O-N 2.86Å
264	K	51	Low	63.3	Low	178 Å²	178	77.5 Å²	77.5	77%	0.774	50%	0.498	S	S	*	.			trans	-69.6	102.7	175.7	-71.2	-169.8	176.7	-171.2	0	109.6	G262 I266	G262-K264 PolarHBondContact O-N 2.88Å; K264-I266 WeakPolarHBondContact O-CG1 3.15Å; K264-I266 PolarHBondContact O-N 3.27Å; K264-I266 VanDerWaalsContact O-N 3.17Å
265	I	54.2	Low	65.5	Low	128 Å²	128	72.4 Å²	72.4	66%	0.656	47%	0.469	S	S	*	.			trans	-54.6	120.9	162.7	-56.1	175.3	0	0	0	106.9	G263	G263-I265 PolarHBondContact O-N 2.86Å
266	I	66.8	Low	67.8	Low	38 Å²	38	67.3 Å²	67.3	20%	0.195	44%	0.437	C	S	.	.			trans	-96.5	105.5	175.7	-50.4	180	0	0	0	105.7	L226 K264 A268	L226-I266 HydrophobicContact CB-CD1 3.95Å; L226-I266 HydrophobicContact CD2-CD1 4.02Å; L226-I266 HydrophobicContact CG-CD1 4.47Å; K264-I266 WeakPolarHBondContact O-CG1 3.15Å; K264-I266 PolarHBondContact O-N 3.27Å; K264-I266 VanDerWaalsContact O-N 3.17Å; I266-A268 HydrophobicContact CG2-CB 3.8Å; I266-A268 PolarHBondContact O-N 2.89Å
267	N	78.4	Confident	70.2	Confident	103 Å²	103	61.1 Å²	61.1	55%	0.551	41%	0.411	S	S	*	.			trans	-68.8	22.8	178.1	-66.5	11.4	0	0	0	113.4	E159 S269	E159-N267 HydrophobicContact CB-CB 4.48Å; E159-N267 VanDerWaalsContact CB-O 3.26Å; E159-N267 WeakPolarHBondContact CB-O 3.01Å; E159-N267 WeakPolarHBondContact OE2-CB 3.43Å; N267-S269 PolarHBondContact O-N 3Å
268	A	89.3	Confident	72.3	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.008	39%	0.393	C	S	.	.			trans	-62	139.1	179.3	0	0	0	0	0	110.3	R158 L160 L210 V248 I266	R158-A268 WeakPolarHBondContact O-CA 3.42Å; L160-A268 HydrophobicContact CD2-CB 3.59Å; L160-A268 HydrophobicContact CG-CB 3.98Å; L210-A268 HydrophobicContact CD2-CB 4.43Å; V248-A268 HydrophobicContact CB-CB 4.08Å; V248-A268 WeakPolarHBondContact CB-O 3.45Å; V248-A268 HydrophobicContact CG2-CB 3.93Å; V248-A268 WeakPolarHBondContact CG2-O 3.3Å; V248-A268 PolarHBondContact N-O 3.02Å; I266-A268 HydrophobicContact CG2-CB 3.8Å; I266-A268 PolarHBondContact O-N 2.89Å
269	S	92.9	Very high	74.6	Confident	15 Å²	15	57 Å²	57	11%	0.105	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.2	173.8	-62.3	0	0	0	0	109.3	A157 R158 Y246 N267	A157-S269 VanDerWaalsContact CA-O 3.26Å; A157-S269 WeakPolarHBondContact CA-O 3.08Å; R158-S269 PolarHBondContact N-O 3.42Å; R158-S269 PolarHBondContact O-N 3.29Å; Y246-S269 CarbonylContact O-C 3.53Å; Y246-S269 WeakPolarHBondContact O-CA 3.45Å; N267-S269 PolarHBondContact O-N 3Å
270	L	95.1	Very high	77.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.5	177.2	-81.7	162.5	0	0	0	109.8	I154 E156 A157 W191 L208 V229 W245 Y246 V248 L272	I154-L270 HydrophobicContact CG2-CD2 4.5Å; E156-L270 CarbonylContact O-C 3.55Å; E156-L270 WeakPolarHBondContact O-CA 3.42Å; A157-L270 HydrophobicContact CB-CD2 3.81Å; A157-L270 HydrophobicContact CB-CG 4.42Å; W191-L270 HydrophobicContact CH2-CD2 4.17Å; W191-L270 HydrophobicContact CZ3-CD2 3.67Å; L208-L270 HydrophobicContact CB-CD1 4.4Å; L208-L270 HydrophobicContact CD1-CD1 4.48Å; V229-L270 HydrophobicContact CB-CD1 4.45Å; V229-L270 HydrophobicContact CG2-CB 4.26Å; V229-L270 HydrophobicContact CG2-CD1 3.9Å; W245-L270 WeakPolarHBondContact CA-O 3.33Å; Y246-L270 PolarHBondContact N-O 2.98Å; Y246-L270 PolarHBondContact O-N 3.01Å; V248-L270 HydrophobicContact CG2-CD1 4.03Å; V248-L270 HydrophobicContact CG2-CG 4.16Å; L270-L272 HydrophobicContact CB-CD1 4.45Å; L270-L272 HydrophobicContact CB-CD2 4.27Å; L270-L272 HydrophobicContact CB-CG 4.24Å
271	R	96.6	Very high	79.4	Confident	83 Å²	83	49 Å²	49	31%	0.313	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.6	170.9	-172.2	-173.8	175.3	170.9	-2.2	109.5	I155 E156 E243 Q244 W245	I155-R271 HydrophobicContact CB-CB 4.42Å; I155-R271 HydrophobicContact CB-CG 4.42Å; I155-R271 WeakPolarHBondContact CB-O 3.4Å; I155-R271 HydrophobicContact CD1-CG 4.25Å; I155-R271 PolarHBondContact N-O 3.49Å; I155-R271 VanDerWaalsContact N-O 3.09Å; E156-R271 HydrophobicContact CG-CB 3.62Å; E156-R271 HydrophobicContact CG-CG 4.39Å; E156-R271 PolarHBondContact O-N 2.88Å; E156-R271 WeakPolarHBondContact OE1-CD 3.4Å; E156-R271 IonicContact OE1-CZ 3.81Å; E156-R271 IonicContact OE1-NE 3.87Å; E156-R271 IonicContact OE1-NH1 3.57Å; E156-R271 PolarHBondContact OE1-NH1 2.92Å; E243-R271 IonicContact OE1-CZ 2.92Å; E243-R271 IonicContact OE1-NE 3.59Å; E243-R271 PolarHBondContact OE1-NE 3.16Å; E243-R271 IonicContact OE1-NH2 2.69Å; E243-R271 PolarHBondContact OE1-NH2 3.07Å; Q244-R271 WeakPolarHBondContact O-CA 3.35Å; W245-R271 HydrophobicContact CD2-CB 3.78Å; W245-R271 HydrophobicContact CD2-CG 4.24Å; W245-R271 HydrophobicContact CE3-CB 3.78Å; W245-R271 HydrophobicContact CG-CB 4.47Å; W245-R271 HydrophobicContact CH2-CB 3.9Å; W245-R271 HydrophobicContact CZ2-CB 3.89Å; W245-R271 HydrophobicContact CZ2-CG 4.28Å; W245-R271 HydrophobicContact CZ3-CB 3.83Å
272	L	96.6	Very high	82.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.8	-172.2	-53.4	173.5	0	0	0	109.5	L152 W153 I154 L208 V229 I231 E243 Q244 Y246 L270	L152-L272 HydrophobicContact CD1-CB 4.47Å; W153-L272 WeakPolarHBondContact O-CA 3.45Å; I154-L272 HydrophobicContact CB-CD2 4.23Å; I154-L272 HydrophobicContact CG1-CD2 4.11Å; I154-L272 HydrophobicContact CG2-CD2 4.01Å; L208-L272 HydrophobicContact CD1-CD1 3.52Å; L208-L272 HydrophobicContact CD1-CD2 3.35Å; L208-L272 HydrophobicContact CD1-CG 4.08Å; L208-L272 HydrophobicContact CG-CD1 4.41Å; V229-L272 HydrophobicContact CG1-CD1 3.96Å; I231-L272 HydrophobicContact CD1-CD1 3.8Å; E243-L272 VanDerWaalsContact CA-O 3.32Å; E243-L272 WeakPolarHBondContact CA-O 3.47Å; Q244-L272 PolarHBondContact N-O 2.9Å; Q244-L272 PolarHBondContact O-N 3Å; Y246-L272 HydrophobicContact CD2-CB 4.06Å; Y246-L272 HydrophobicContact CD2-CD1 3.74Å; Y246-L272 HydrophobicContact CD2-CG 4.05Å; Y246-L272 HydrophobicContact CE2-CB 4Å; Y246-L272 HydrophobicContact CE2-CD1 4.23Å; Y246-L272 HydrophobicContact CE2-CG 4.48Å; Y246-L272 HydrophobicContact CG-CD1 4.4Å; L270-L272 HydrophobicContact CB-CD1 4.45Å; L270-L272 HydrophobicContact CB-CD2 4.27Å; L270-L272 HydrophobicContact CB-CG 4.24Å
273	K	96.3	Very high	84.8	Confident	30 Å²	30	42.6 Å²	42.6	13%	0.13	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.2	172.4	175.5	-176.9	-177.1	173.7	0	109.1	L152 W153 I155 F241 V242 E243	L152-K273 CarbonylContact C-O 3.59Å; L152-K273 WeakPolarHBondContact CA-O 3.42Å; W153-K273 HydrophobicContact CB-CB 4.24Å; W153-K273 HydrophobicContact CE3-CD 4.34Å; W153-K273 HydrophobicContact CE3-CG 4.36Å; W153-K273 PolarHBondContact N-O 3.39Å; W153-K273 PolarHBondContact O-N 3.05Å; W153-K273 VanDerWaalsContact O-N 3.12Å; I155-K273 HydrophobicContact CD1-CB 3.96Å; F241-K273 HydrophobicContact CB-CD 4.41Å; F241-K273 HydrophobicContact CB-CG 3.96Å; F241-K273 HydrophobicContact CD1-CG 3.97Å; F241-K273 HydrophobicContact CG-CG 4.21Å; V242-K273 CarbonylContact O-C 3.46Å; V242-K273 WeakPolarHBondContact O-CA 3.46Å; E243-K273 HydrophobicContact CB-CB 4Å; E243-K273 HydrophobicContact CB-CG 4.12Å; E243-K273 HydrophobicContact CG-CB 3.93Å; E243-K273 HydrophobicContact CG-CG 4.48Å
274	S	95.4	Very high	87.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	149	-171.6	56.5	0	0	0	0	114.1	K151 I236 V242	K151-S274 VanDerWaalsContact O-CA 3.32Å; K151-S274 WeakPolarHBondContact O-CA 3.43Å; I236-S274 WeakPolarHBondContact CG2-OG 3.14Å; V242-S274 PolarHBondContact N-O 3.39Å; V242-S274 PolarHBondContact O-N 3.4Å
275	R	94.7	Very high	89.1	Confident	32 Å²	32	40.8 Å²	40.8	12%	0.121	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	121.5	175	174.1	172.6	155.7	179.6	-12.3	107.4	K151 G238 R239 F241 Q277 E316	K151-R275 PolarHBondContact N-O 2.65Å; K151-R275 PolarHBondContact O-N 2.85Å; G238-R275 WeakPolarHBondContact O-CG 3.42Å; R239-R275 WeakPolarHBondContact O-CD 3.27Å; R239-R275 PolarHBondContact O-NE 3.45Å; R239-R275 PolarHBondContact O-NH1 3.24Å; F241-R275 HydrophobicContact CD1-CB 3.4Å; F241-R275 VanDerWaalsContact CD1-CB 3.4Å; F241-R275 HydrophobicContact CE1-CB 3.29Å; F241-R275 HydrophobicContact CE1-CG 4.34Å; F241-R275 HydrophobicContact CE2-CB 4.46Å; F241-R275 HydrophobicContact CG-CB 4.03Å; F241-R275 HydrophobicContact CZ-CB 3.89Å; F241-R275 HydrophobicContact CZ-CG 4.49Å; R275-Q277 HydrophobicContact CG-CG 4.25Å; R275-E316 IonicContact CZ-OE1 3.26Å; R275-E316 IonicContact NH1-OE1 2.79Å; R275-E316 PolarHBondContact NH1-OE1 3.13Å; R275-E316 IonicContact NH2-OE1 2.65Å; R275-E316 PolarHBondContact NH2-OE1 3.31Å
276	F	94	Very high	90.9	Very high	6 Å²	6	38 Å²	38	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.8	168.7	-172.3	-94.4	0	0	0	109.4	N148 V149 L150 L200 I233 I236 T237 G238 T278	N148-F276 HydrophobicContact CB-CE1 4.44Å; N148-F276 HydrophobicContact CB-CE2 4.18Å; N148-F276 HydrophobicContact CB-CZ 3.7Å; V149-F276 CarbonylContact O-C 3.49Å; V149-F276 WeakPolarHBondContact O-CA 3.48Å; L150-F276 HydrophobicContact CB-CD2 4.08Å; L150-F276 HydrophobicContact CD1-CB 4.36Å; L150-F276 HydrophobicContact CD1-CD2 4.27Å; L200-F276 HydrophobicContact CD1-CE2 4.24Å; I233-F276 HydrophobicContact CD1-CD2 4.1Å; I233-F276 HydrophobicContact CD1-CE2 4.47Å; I233-F276 HydrophobicContact CD1-CG 4.5Å; I233-F276 HydrophobicContact CG2-CB 4.02Å; I233-F276 HydrophobicContact CG2-CD1 3.25Å; I233-F276 HydrophobicContact CG2-CD2 3.88Å; I233-F276 HydrophobicContact CG2-CE1 3.5Å; I233-F276 VanDerWaalsContact CG2-CE1 3.5Å; I233-F276 HydrophobicContact CG2-CE2 4.09Å; I233-F276 HydrophobicContact CG2-CG 3.45Å; I233-F276 VanDerWaalsContact CG2-CG 3.45Å; I233-F276 HydrophobicContact CG2-CZ 3.91Å; I236-F276 HydrophobicContact CD1-CB 4.24Å; I236-F276 HydrophobicContact CG1-CB 4.07Å; I236-F276 PolarHBondContact O-N 3.08Å; T237-F276 CarbonylContact C-O 3.56Å; T237-F276 VanDerWaalsContact CA-O 3.32Å; T237-F276 WeakPolarHBondContact CA-O 3.43Å; G238-F276 PolarHBondContact N-O 2.94Å; F276-T278 WeakPolarHBondContact CE1-OG1 3.49Å
277	Q	91.8	Very high	92.3	Very high	46 Å²	46	36.1 Å²	36.1	22%	0.215	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	131.8	176.3	-73.7	-172.9	-97.4	0	0	110.7	N148 V149 G238 R275	N148-Q277 CarbonylContact C-O 3.57Å; N148-Q277 VanDerWaalsContact CA-O 3.27Å; N148-Q277 WeakPolarHBondContact CA-O 3.46Å; V149-Q277 PolarHBondContact N-O 3.44Å; V149-Q277 PolarHBondContact O-N 3.41Å; G238-Q277 WeakPolarHBondContact O-CG 3.37Å; R275-Q277 HydrophobicContact CG-CG 4.25Å
278	T	90.1	Very high	93.1	Very high	70 Å²	70	37.2 Å²	37.2	43%	0.429	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.5	166.8	-61.9	0	0	0	0	108	V146 D147 N148 F276	V146-T278 HydrophobicContact CG1-CG2 3.49Å; V146-T278 VanDerWaalsContact CG1-CG2 3.49Å; D147-T278 WeakPolarHBondContact O-CA 3.21Å; N148-T278 WeakPolarHBondContact OD1-CB 3.44Å; N148-T278 WeakPolarHBondContact OD1-CG2 3.5Å; N148-T278 PolarHBondContact OD1-OG1 2.95Å; F276-T278 WeakPolarHBondContact CE1-OG1 3.49Å
279	M	88.3	Confident	93.4	Very high	22 Å²	22	42.3 Å²	42.3	11%	0.108	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.3	179.5	-61.2	-173.8	-63.7	0	0	109.7	V146 D147 V149 R557 I561	V146-M279 WeakPolarHBondContact CA-O 3.5Å; D147-M279 HydrophobicContact CB-CE 4.35Å; D147-M279 PolarHBondContact N-O 3.02Å; D147-M279 PolarHBondContact O-N 3.3Å; D147-M279 WeakPolarHBondContact OD2-CE 3.31Å; V149-M279 HydrophobicContact CG2-CE 4.11Å; M279-R557 HydrophobicContact CE-CG 3.91Å; M279-I561 HydrophobicContact CE-CD1 4.2Å; M279-I561 HydrophobicContact CE-CG1 4.28Å; M279-I561 HydrophobicContact SD-CD1 4.13Å; M279-I561 HydrophobicContact SD-CG1 3.61Å
280	N	90.4	Very high	93.6	Very high	69 Å²	69	41.7 Å²	41.7	37%	0.369	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.3	173.8	-72.4	-84.4	0	0	0	108.5	S560 L595	N280-S560 PolarHBondContact O-OG 2.94Å; N280-L595 HydrophobicContact CB-CD2 3.98Å; N280-L595 WeakPolarHBondContact O-CD2 3.26Å
281	I	92.6	Very high	93.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.6	179.7	-60.6	164	0	0	0	108	R144 R145 D147 Y287 R557	R144-I281 CarbonylContact C-O 3.6Å; R144-I281 WeakPolarHBondContact CA-O 3.27Å; R145-I281 HydrophobicContact CG-CB 3.76Å; R145-I281 HydrophobicContact CG-CD1 4.18Å; R145-I281 HydrophobicContact CG-CG2 4.12Å; R145-I281 PolarHBondContact N-O 3.15Å; R145-I281 PolarHBondContact O-N 3.45Å; D147-I281 HydrophobicContact CB-CD1 3.88Å; I281-Y287 HydrophobicContact CG2-CE2 4.11Å; I281-R557 HydrophobicContact CD1-CB 3.74Å; I281-R557 HydrophobicContact CD1-CG 4.46Å
282	L	93.1	Very high	93.6	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-81.2	164.8	175.7	-60.3	177.2	0	0	0	111.9	L286 Y287 I591 A594 L595	L282-L286 HydrophobicContact CB-CB 4.37Å; L282-L286 HydrophobicContact CB-CD1 4.28Å; L282-L286 HydrophobicContact CD1-CB 4.25Å; L282-L286 HydrophobicContact CD1-CD1 3.97Å; L282-Y287 HydrophobicContact CB-CD2 4.38Å; L282-Y287 HydrophobicContact CB-CE2 3.67Å; L282-Y287 PolarHBondContact N-OH 2.99Å; L282-Y287 WeakPolarHBondContact O-CE2 3.01Å; L282-I591 HydrophobicContact CD1-CG2 4.04Å; L282-A594 HydrophobicContact CD1-CB 3.61Å; L282-A594 HydrophobicContact CD2-CB 4.26Å; L282-L595 HydrophobicContact CD1-CD2 4.25Å; L282-L595 HydrophobicContact CD1-CG 4.14Å; L282-L595 HydrophobicContact CD2-CD2 4Å; L282-L595 HydrophobicContact CD2-CG 4.49Å; L282-L595 HydrophobicContact CG-CD2 3.84Å; L282-L595 HydrophobicContact CG-CG 4.28Å
283	P	92.2	Very high	93.7	Very high	9 Å²	9	43.4 Å²	43.4	6%	0.058	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-53.9	140.4	165.4	-27.8	37.9	0	0	0	112.1	N142 E285 L286	N142-P283 WeakPolarHBondContact O-CG 3.19Å; P283-E285 PolarHBondContact O-N 3.39Å; P283-E285 VanDerWaalsContact O-N 3.08Å; P283-L286 PolarHBondContact O-N 2.89Å
284	M	90.8	Very high	93.7	Very high	49 Å²	49	42 Å²	42	24%	0.241	21%	0.205	C	C	.	.	H	α-helix	trans	-53.6	-33.5	-174	-177.4	55.6	65	0	0	113.8	D141 L286 Y287 K288 L555 L559	D141-M284 PolarHBondContact O-N 3.06Å; M284-L286 PolarHBondContact O-N 3.15Å; M284-Y287 PolarHBondContact O-N 3.43Å; M284-K288 PolarHBondContact O-N 3.34Å; M284-L555 HydrophobicContact CE-CB 3.96Å; M284-L555 HydrophobicContact CE-CD2 4.27Å; M284-L555 HydrophobicContact CE-CG 3.91Å; M284-L555 HydrophobicContact SD-CD2 4.42Å; M284-L555 HydrophobicContact SD-CG 4.41Å; M284-L559 HydrophobicContact SD-CD1 4.08Å
285	E	90.9	Very high	93.8	Very high	154 Å²	154	42.9 Å²	42.9	72%	0.72	21%	0.21	S	C	*	.	H	α-helix	trans	-52.9	-39.8	176.2	-174.4	172	-142.2	0	0	112.9	P283 Y287 K288	P283-E285 PolarHBondContact O-N 3.39Å; P283-E285 VanDerWaalsContact O-N 3.08Å; E285-Y287 VanDerWaalsContact C-N 3.31Å; E285-Y287 PolarHBondContact O-N 2.65Å; E285-K288 WeakPolarHBondContact O-CB 3.38Å; E285-K288 PolarHBondContact O-N 2.97Å
286	L	93.3	Very high	93.8	Very high	69 Å²	69	47 Å²	47	36%	0.361	24%	0.235	S	C	.	.	H	α-helix	trans	-74.4	-18.6	179.4	-64.1	-174.4	0	0	0	113.6	L282 P283 M284 A594	L282-L286 HydrophobicContact CB-CB 4.37Å; L282-L286 HydrophobicContact CB-CD1 4.28Å; L282-L286 HydrophobicContact CD1-CB 4.25Å; L282-L286 HydrophobicContact CD1-CD1 3.97Å; P283-L286 PolarHBondContact O-N 2.89Å; M284-L286 PolarHBondContact O-N 3.15Å; L286-A594 HydrophobicContact CD1-CB 3.84Å
287	Y	95.6	Very high	93.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-93.3	-5.4	172.9	-61.3	-70.1	0	0	0	113.1	I281 L282 M284 E285 F290 A291 L559 S560 I591	I281-Y287 HydrophobicContact CG2-CE2 4.11Å; L282-Y287 HydrophobicContact CB-CD2 4.38Å; L282-Y287 HydrophobicContact CB-CE2 3.67Å; L282-Y287 PolarHBondContact N-OH 2.99Å; L282-Y287 WeakPolarHBondContact O-CE2 3.01Å; M284-Y287 PolarHBondContact O-N 3.43Å; E285-Y287 VanDerWaalsContact C-N 3.31Å; E285-Y287 PolarHBondContact O-N 2.65Å; Y287-F290 HydrophobicContact CD1-CD1 4.43Å; Y287-F290 CarbonylContact O-C 3.45Å; Y287-F290 WeakPolarHBondContact O-CB 3.46Å; Y287-F290 PolarHBondContact O-N 2.98Å; Y287-F290 VanDerWaalsContact O-N 3.1Å; Y287-A291 PolarHBondContact O-N 3.05Å; Y287-L559 HydrophobicContact CD1-CB 4.01Å; Y287-L559 HydrophobicContact CE1-CB 4.5Å; Y287-L559 HydrophobicContact CG-CB 4.05Å; Y287-L559 HydrophobicContact CG-CD1 4.42Å; Y287-S560 WeakPolarHBondContact OH-CB 3.48Å; Y287-S560 PolarHBondContact OH-OG 3.28Å; Y287-I591 HydrophobicContact CD1-CD1 3.88Å; Y287-I591 HydrophobicContact CD1-CG1 4.28Å; Y287-I591 HydrophobicContact CD1-CG2 4.32Å; Y287-I591 HydrophobicContact CE1-CD1 4.39Å; Y287-I591 HydrophobicContact CE1-CG2 3.79Å
288	K	94.4	Very high	94.1	Very high	125 Å²	125	48.3 Å²	48.3	54%	0.543	24%	0.242	S	C	.	.	H	α-helix	trans	-59.6	-53.8	-169.2	-175.8	-179.7	169.4	-174.2	0	113.8	M284 E285 F290 A291 E292	M284-K288 PolarHBondContact O-N 3.34Å; E285-K288 WeakPolarHBondContact O-CB 3.38Å; E285-K288 PolarHBondContact O-N 2.97Å; K288-F290 PolarHBondContact O-N 3.42Å; K288-A291 PolarHBondContact O-N 3.14Å; K288-E292 WeakPolarHBondContact CE-OE1 3Å; K288-E292 IonicContact NZ-OE1 3.24Å; K288-E292 WeakPolarHBondContact O-CG 3.28Å; K288-E292 PolarHBondContact O-N 3.15Å
289	E	95.9	Very high	94.4	Very high	108 Å²	108	51 Å²	51	51%	0.505	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-32.6	176.8	-74.8	-160.5	120.5	0	0	112	Y293 R586 L587	E289-Y293 WeakPolarHBondContact O-CB 3.28Å; E289-Y293 PolarHBondContact O-N 3.06Å; E289-R586 IonicContact OE1-NH2 3.69Å; E289-R586 PolarHBondContact OE1-NH2 2.94Å; E289-R586 IonicContact OE2-CZ 2.76Å; E289-R586 IonicContact OE2-NH1 2.72Å; E289-R586 PolarHBondContact OE2-NH1 2.76Å; E289-R586 VanDerWaalsContact OE2-NH1 3.1Å; E289-R586 IonicContact OE2-NH2 2.74Å; E289-R586 PolarHBondContact OE2-NH2 3.01Å; E289-L587 HydrophobicContact CB-CD1 4.42Å; E289-L587 HydrophobicContact CB-CD2 3.53Å; E289-L587 HydrophobicContact CG-CD2 4.35Å; E289-L587 WeakPolarHBondContact OE2-CD2 3.48Å
290	F	97.6	Very high	94.7	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.009	26%	0.256	C	S	.	.	H	α-helix	trans	-73.3	-42.3	178.6	173.4	-123.2	0	0	0	112.2	Y287 K288 Y293 V294 L559 L562 H563 L566 L584 L587 L588 I591	Y287-F290 HydrophobicContact CD1-CD1 4.43Å; Y287-F290 CarbonylContact O-C 3.45Å; Y287-F290 WeakPolarHBondContact O-CB 3.46Å; Y287-F290 PolarHBondContact O-N 2.98Å; Y287-F290 VanDerWaalsContact O-N 3.1Å; K288-F290 PolarHBondContact O-N 3.42Å; F290-Y293 PolarHBondContact O-N 3.39Å; F290-V294 HydrophobicContact CD2-CG2 4.06Å; F290-V294 HydrophobicContact CE2-CG2 3.66Å; F290-V294 HydrophobicContact CZ-CG2 4.05Å; F290-V294 WeakPolarHBondContact O-CG2 3.47Å; F290-V294 PolarHBondContact O-N 2.91Å; F290-L559 HydrophobicContact CD1-CB 4.42Å; F290-L559 HydrophobicContact CD1-CD2 3.74Å; F290-L559 HydrophobicContact CE1-CB 4.34Å; F290-L559 HydrophobicContact CE1-CD2 3.81Å; F290-L559 WeakPolarHBondContact CE1-O 3.19Å; F290-L562 HydrophobicContact CE1-CB 4.5Å; F290-L562 HydrophobicContact CZ-CB 4.23Å; F290-L562 HydrophobicContact CZ-CD2 3.93Å; F290-L562 HydrophobicContact CZ-CG 3.97Å; F290-H563 HydrophobicContact CE1-CB 4.18Å; F290-L566 HydrophobicContact CE2-CD1 3.86Å; F290-L566 HydrophobicContact CZ-CD1 3.96Å; F290-L584 HydrophobicContact CD2-CD1 3.83Å; F290-L584 HydrophobicContact CE2-CD1 3.68Å; F290-L587 HydrophobicContact CB-CB 4.5Å; F290-L588 HydrophobicContact CD2-CD2 4.21Å; F290-L588 HydrophobicContact CE2-CD2 3.73Å; F290-L588 HydrophobicContact CZ-CD2 4.03Å; F290-I591 HydrophobicContact CB-CD1 3.78Å; F290-I591 HydrophobicContact CD1-CD1 3.89Å; F290-I591 HydrophobicContact CG-CD1 3.91Å
291	A	96.5	Very high	94.9	Very high	10 Å²	10	49.4 Å²	49.4	8%	0.083	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-42.3	173.2	0	0	0	0	0	111.8	Y287 K288 V294 T295 L559	Y287-A291 PolarHBondContact O-N 3.05Å; K288-A291 PolarHBondContact O-N 3.14Å; A291-V294 PolarHBondContact O-N 2.97Å; A291-T295 VanDerWaalsContact O-CB 3.26Å; A291-T295 WeakPolarHBondContact O-CB 3.46Å; A291-T295 PolarHBondContact O-N 3.32Å; A291-T295 PolarHBondContact O-OG1 2.88Å; A291-L559 HydrophobicContact CB-CD1 3.81Å; A291-L559 HydrophobicContact CB-CD2 3.86Å
292	E	96.3	Very high	95.1	Very high	99 Å²	99	49.6 Å²	49.6	46%	0.463	24%	0.24	S	C	.	.	H	α-helix	trans	-63.9	-41.7	173.5	-72.9	178.6	-161.7	0	0	111.5	K288 N296	K288-E292 WeakPolarHBondContact CE-OE1 3Å; K288-E292 IonicContact NZ-OE1 3.24Å; K288-E292 WeakPolarHBondContact O-CG 3.28Å; K288-E292 PolarHBondContact O-N 3.15Å; E292-N296 WeakPolarHBondContact O-CB 3.47Å; E292-N296 PolarHBondContact O-N 3.17Å; E292-N296 VanDerWaalsContact O-N 3.16Å; E292-N296 PolarHBondContact O-ND2 2.98Å
293	Y	97.4	Very high	95.1	Very high	11 Å²	11	53 Å²	53	4%	0.043	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-52.5	174	174.3	-87.3	0	0	0	111.6	E289 F290 T295 N296 N297 L581 P583 L584 L587	E289-Y293 WeakPolarHBondContact O-CB 3.28Å; E289-Y293 PolarHBondContact O-N 3.06Å; F290-Y293 PolarHBondContact O-N 3.39Å; Y293-T295 VanDerWaalsContact C-N 3.33Å; Y293-T295 PolarHBondContact O-N 3.37Å; Y293-N296 PolarHBondContact O-N 2.98Å; Y293-N297 HydrophobicContact CD2-CB 4.31Å; Y293-N297 HydrophobicContact CE1-CB 4.1Å; Y293-N297 HydrophobicContact CE2-CB 3.91Å; Y293-N297 VanDerWaalsContact O-CB 3.31Å; Y293-N297 WeakPolarHBondContact O-CB 3.44Å; Y293-N297 PolarHBondContact O-N 2.86Å; Y293-N297 PolarHBondContact O-ND2 3.19Å; Y293-L581 VanDerWaalsContact CE2-O 3.25Å; Y293-L581 WeakPolarHBondContact CE2-O 3.21Å; Y293-L581 WeakPolarHBondContact OH-CA 3.23Å; Y293-L581 PolarHBondContact OH-O 3.44Å; Y293-P583 HydrophobicContact CD2-CG 3.81Å; Y293-P583 HydrophobicContact CE2-CG 4.08Å; Y293-L584 HydrophobicContact CD1-CB 4.3Å; Y293-L584 HydrophobicContact CD1-CD1 3.88Å; Y293-L584 HydrophobicContact CD1-CG 4.5Å; Y293-L584 HydrophobicContact CE1-CB 3.82Å; Y293-L584 HydrophobicContact CE1-CD1 3.89Å; Y293-L584 HydrophobicContact CE1-CD2 3.86Å; Y293-L584 HydrophobicContact CE1-CG 4.07Å; Y293-L584 HydrophobicContact CE2-CB 4.13Å; Y293-L587 HydrophobicContact CG-CD1 4.24Å
294	V	97.2	Very high	95.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-44.2	-178.5	169.9	0	0	0	0	110.9	F290 A291 N296 Y298 L301 L321 I324 L562	F290-V294 HydrophobicContact CD2-CG2 4.06Å; F290-V294 HydrophobicContact CE2-CG2 3.66Å; F290-V294 HydrophobicContact CZ-CG2 4.05Å; F290-V294 WeakPolarHBondContact O-CG2 3.47Å; F290-V294 PolarHBondContact O-N 2.91Å; A291-V294 PolarHBondContact O-N 2.97Å; V294-N296 VanDerWaalsContact C-N 3.28Å; V294-N296 PolarHBondContact O-N 3.43Å; V294-Y298 PolarHBondContact O-N 3.42Å; V294-L301 HydrophobicContact CG2-CD2 4.35Å; V294-L321 HydrophobicContact CG1-CD2 3.63Å; V294-I324 HydrophobicContact CG1-CG2 4.07Å; V294-L562 HydrophobicContact CG1-CD2 4.06Å; V294-L562 HydrophobicContact CG2-CD2 3.79Å
295	T	96.3	Very high	95.4	Very high	19 Å²	19	51 Å²	51	12%	0.117	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-30.6	-179.5	-58.4	0	0	0	0	113.2	A291 Y293 Y298 T328 K330	A291-T295 VanDerWaalsContact O-CB 3.26Å; A291-T295 WeakPolarHBondContact O-CB 3.46Å; A291-T295 PolarHBondContact O-N 3.32Å; A291-T295 PolarHBondContact O-OG1 2.88Å; Y293-T295 VanDerWaalsContact C-N 3.33Å; Y293-T295 PolarHBondContact O-N 3.37Å; T295-Y298 VanDerWaalsContact O-CD1 3.32Å; T295-Y298 WeakPolarHBondContact O-CD1 3.33Å; T295-Y298 WeakPolarHBondContact O-CE1 3.5Å; T295-T328 WeakPolarHBondContact CG2-OG1 3.47Å; T295-T328 PolarHBondContact OG1-OG1 2.78Å; T295-K330 HydrophobicContact CG2-CB 4.25Å; T295-K330 HydrophobicContact CG2-CG 3.67Å
296	N	95.9	Very high	95.5	Very high	119 Å²	119	45.4 Å²	45.4	64%	0.636	23%	0.232	S	C	*	.	H	α-helix	trans	-99	-20.2	-178.6	-68.3	-64.4	0	0	0	114.5	E292 Y293 V294	E292-N296 WeakPolarHBondContact O-CB 3.47Å; E292-N296 PolarHBondContact O-N 3.17Å; E292-N296 VanDerWaalsContact O-N 3.16Å; E292-N296 PolarHBondContact O-ND2 2.98Å; Y293-N296 PolarHBondContact O-N 2.98Å; V294-N296 VanDerWaalsContact C-N 3.28Å; V294-N296 PolarHBondContact O-N 3.43Å
297	N	96.1	Very high	95.4	Very high	58 Å²	58	47.2 Å²	47.2	31%	0.31	25%	0.248	S	C	.	.	H	α-helix	trans	-121.4	12.5	-170.4	-58.9	-91.8	0	0	0	114.1	Y293 R299 T300 L301	Y293-N297 HydrophobicContact CD2-CB 4.31Å; Y293-N297 HydrophobicContact CE1-CB 4.1Å; Y293-N297 HydrophobicContact CE2-CB 3.91Å; Y293-N297 VanDerWaalsContact O-CB 3.31Å; Y293-N297 WeakPolarHBondContact O-CB 3.44Å; Y293-N297 PolarHBondContact O-N 2.86Å; Y293-N297 PolarHBondContact O-ND2 3.19Å; N297-R299 PolarHBondContact O-N 3.05Å; N297-R299 VanDerWaalsContact O-N 3.08Å; N297-T300 PolarHBondContact O-N 2.84Å; N297-T300 VanDerWaalsContact O-N 3.08Å; N297-L301 PolarHBondContact O-N 2.94Å
298	Y	96.1	Very high	95.3	Very high	20 Å²	20	49.6 Å²	49.6	8%	0.078	26%	0.262	C	S	.	.	H	α-helix	trans	-51.7	-34.7	-176.3	56.6	-101.4	0	0	0	114.3	V294 T295 C302 L325 F334 D337	V294-Y298 PolarHBondContact O-N 3.42Å; T295-Y298 VanDerWaalsContact O-CD1 3.32Å; T295-Y298 WeakPolarHBondContact O-CD1 3.33Å; T295-Y298 WeakPolarHBondContact O-CE1 3.5Å; Y298-C302 WeakPolarHBondContact O-CB 3Å; Y298-C302 PolarHBondContact O-N 2.85Å; Y298-C302 PolarHBondContact O-SG 2.9Å; Y298-L325 HydrophobicContact CD1-CD1 4.39Å; Y298-L325 HydrophobicContact CD1-CD2 4.02Å; Y298-L325 HydrophobicContact CG-CD1 4.27Å; Y298-F334 HydrophobicContact CD2-CB 4.19Å; Y298-F334 AromaticContact CD2-CD2 3.49Å; Y298-F334 HydrophobicContact CD2-CD2 3.49Å; Y298-F334 VanDerWaalsContact CD2-CD2 3.49Å; Y298-F334 HydrophobicContact CD2-CE2 4.31Å; Y298-F334 HydrophobicContact CD2-CG 4.26Å; Y298-F334 HydrophobicContact CE2-CB 4.04Å; Y298-F334 HydrophobicContact CE2-CD2 4.05Å; Y298-F334 HydrophobicContact CG-CD2 4.01Å; Y298-D337 HydrophobicContact CE2-CB 4.4Å; Y298-D337 PolarHBondContact OH-OD2 3.37Å; Y298-D337 VanDerWaalsContact OH-OD2 3.14Å
299	R	94.9	Very high	95.3	Very high	126 Å²	126	44.3 Å²	44.3	48%	0.475	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-53.4	176.3	-69.4	-178.5	171.3	-122.1	23.4	111.7	N297 L301 C302 A303 D337	N297-R299 PolarHBondContact O-N 3.05Å; N297-R299 VanDerWaalsContact O-N 3.08Å; R299-L301 VanDerWaalsContact C-N 3.33Å; R299-L301 PolarHBondContact O-N 3.43Å; R299-C302 PolarHBondContact O-N 3.45Å; R299-A303 VanDerWaalsContact O-CB 3.32Å; R299-A303 WeakPolarHBondContact O-CB 3.46Å; R299-A303 PolarHBondContact O-N 3.32Å; R299-D337 IonicContact CZ-OD1 3.78Å; R299-D337 IonicContact CZ-OD2 3.8Å; R299-D337 IonicContact NE-OD2 2.72Å; R299-D337 PolarHBondContact NE-OD2 3.05Å; R299-D337 IonicContact NH2-OD1 3.4Å; R299-D337 PolarHBondContact NH2-OD1 3.49Å; R299-D337 IonicContact NH2-OD2 3.43Å; R299-D337 PolarHBondContact NH2-OD2 3.02Å
300	T	94.8	Very high	95.1	Very high	59 Å²	59	42.1 Å²	42.1	36%	0.362	24%	0.237	S	C	.	.	H	α-helix	trans	-63.7	-41.2	178.7	-49.1	0	0	0	0	111	N297 A303 V304 K580	N297-T300 PolarHBondContact O-N 2.84Å; N297-T300 VanDerWaalsContact O-N 3.08Å; T300-A303 PolarHBondContact O-N 3.13Å; T300-V304 WeakPolarHBondContact O-CB 3.12Å; T300-V304 WeakPolarHBondContact O-CG2 3.27Å; T300-V304 PolarHBondContact O-N 3.05Å; T300-K580 WeakPolarHBondContact CG2-O 3.12Å
301	L	95.3	Very high	94.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.2	-52.1	176.5	-175.9	61.7	0	0	0	111.3	V294 N297 R299 V304 L305 L321 L566 L581 L584	V294-L301 HydrophobicContact CG2-CD2 4.35Å; N297-L301 PolarHBondContact O-N 2.94Å; R299-L301 VanDerWaalsContact C-N 3.33Å; R299-L301 PolarHBondContact O-N 3.43Å; L301-V304 PolarHBondContact O-N 3.33Å; L301-L305 HydrophobicContact CD1-CD1 3.68Å; L301-L305 HydrophobicContact CD1-CG 4.31Å; L301-L305 HydrophobicContact CG-CD1 3.81Å; L301-L305 WeakPolarHBondContact O-CB 3.37Å; L301-L305 WeakPolarHBondContact O-CD1 3.24Å; L301-L305 WeakPolarHBondContact O-CG 3.2Å; L301-L305 PolarHBondContact O-N 3.21Å; L301-L305 VanDerWaalsContact O-N 3.07Å; L301-L321 HydrophobicContact CD2-CD2 4.01Å; L301-L566 HydrophobicContact CD1-CD1 4.46Å; L301-L566 HydrophobicContact CD1-CD2 4.14Å; L301-L581 HydrophobicContact CD1-CD2 3.8Å; L301-L584 HydrophobicContact CD1-CD2 3.73Å
302	C	95.7	Very high	94.4	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.02	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-45.6	177.8	-65.9	0	0	0	0	111.8	Y298 R299 V304 L305 E306 M338 L359	Y298-C302 WeakPolarHBondContact O-CB 3Å; Y298-C302 PolarHBondContact O-N 2.85Å; Y298-C302 PolarHBondContact O-SG 2.9Å; R299-C302 PolarHBondContact O-N 3.45Å; C302-V304 VanDerWaalsContact C-N 3.27Å; C302-V304 PolarHBondContact O-N 3.12Å; C302-L305 PolarHBondContact O-N 2.84Å; C302-L305 VanDerWaalsContact O-N 3.15Å; C302-E306 VanDerWaalsContact O-CB 3.27Å; C302-E306 WeakPolarHBondContact O-CB 3.31Å; C302-E306 PolarHBondContact O-N 3.26Å; C302-M338 HydrophobicContact CB-CE 3.8Å; C302-M338 HydrophobicContact CB-SD 3.85Å; C302-L359 HydrophobicContact CB-CD1 3.94Å
303	A	93.4	Very high	94.1	Very high	72 Å²	72	47.4 Å²	47.4	60%	0.595	27%	0.265	S	S	*	.	H	α-helix	trans	-62	-31.2	-179.4	0	0	0	0	0	113.8	R299 T300	R299-A303 VanDerWaalsContact O-CB 3.32Å; R299-A303 WeakPolarHBondContact O-CB 3.46Å; R299-A303 PolarHBondContact O-N 3.32Å; T300-A303 PolarHBondContact O-N 3.13Å
304	V	95	Very high	94	Very high	15 Å²	15	48 Å²	48	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-79.9	-33.3	175.1	171	0	0	0	0	112.3	T300 L301 C302 L573 A577 K580 L581	T300-V304 WeakPolarHBondContact O-CB 3.12Å; T300-V304 WeakPolarHBondContact O-CG2 3.27Å; T300-V304 PolarHBondContact O-N 3.05Å; L301-V304 PolarHBondContact O-N 3.33Å; C302-V304 VanDerWaalsContact C-N 3.27Å; C302-V304 PolarHBondContact O-N 3.12Å; V304-L573 HydrophobicContact CG1-CD1 4.39Å; V304-L573 HydrophobicContact CG1-CD2 4.37Å; V304-A577 HydrophobicContact CG1-CB 3.71Å; V304-K580 HydrophobicContact CG2-CB 4.06Å; V304-K580 HydrophobicContact CG2-CD 4.42Å; V304-L581 HydrophobicContact CB-CD2 4.16Å; V304-L581 HydrophobicContact CB-CG 4.43Å; V304-L581 HydrophobicContact CG1-CD1 3.89Å; V304-L581 HydrophobicContact CG1-CD2 4.25Å; V304-L581 HydrophobicContact CG1-CG 4.05Å; V304-L581 HydrophobicContact CG2-CD2 4.38Å
305	L	94.8	Very high	93.9	Very high	2 Å²	2	51 Å²	51	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-84.8	-33.3	-177.2	-68.8	172.8	0	0	0	114.1	L301 C302 P307 V308 L309 V317 L359 L566 V569	L301-L305 HydrophobicContact CD1-CD1 3.68Å; L301-L305 HydrophobicContact CD1-CG 4.31Å; L301-L305 HydrophobicContact CG-CD1 3.81Å; L301-L305 WeakPolarHBondContact O-CB 3.37Å; L301-L305 WeakPolarHBondContact O-CD1 3.24Å; L301-L305 WeakPolarHBondContact O-CG 3.2Å; L301-L305 PolarHBondContact O-N 3.21Å; L301-L305 VanDerWaalsContact O-N 3.07Å; C302-L305 PolarHBondContact O-N 2.84Å; C302-L305 VanDerWaalsContact O-N 3.15Å; L305-P307 VanDerWaalsContact C-CD 3.46Å; L305-V308 PolarHBondContact O-N 3.3Å; L305-L309 HydrophobicContact CB-CD1 3.81Å; L305-L309 HydrophobicContact CB-CG 4.03Å; L305-L309 WeakPolarHBondContact O-CG 3.36Å; L305-L309 PolarHBondContact O-N 2.84Å; L305-V317 HydrophobicContact CD1-CG1 4.38Å; L305-L359 HydrophobicContact CB-CD1 4.25Å; L305-L566 HydrophobicContact CD1-CD2 3.56Å; L305-L566 HydrophobicContact CD2-CD2 4.17Å; L305-L566 HydrophobicContact CG-CD2 4.5Å; L305-V569 HydrophobicContact CD2-CG1 3.74Å
306	E	93.1	Very high	93.7	Very high	37 Å²	37	52.6 Å²	52.6	17%	0.173	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-44.3	-176.7	-175.9	61.4	-136.6	0	0	114.9	C302 K314 T358 L359	C302-E306 VanDerWaalsContact O-CB 3.27Å; C302-E306 WeakPolarHBondContact O-CB 3.31Å; C302-E306 PolarHBondContact O-N 3.26Å; E306-K314 WeakPolarHBondContact O-CE 3.29Å; E306-K314 PolarHBondContact O-NZ 3.25Å; E306-K314 VanDerWaalsContact O-NZ 3.14Å; E306-K314 WeakPolarHBondContact OE1-CE 3.34Å; E306-K314 IonicContact OE1-NZ 3.3Å; E306-K314 PolarHBondContact OE1-NZ 2.89Å; E306-T358 VanDerWaalsContact OE1-CA 3.23Å; E306-T358 WeakPolarHBondContact OE1-CA 3.47Å; E306-T358 VanDerWaalsContact OE1-CB 3.26Å; E306-T358 WeakPolarHBondContact OE1-CB 3.38Å; E306-L359 HydrophobicContact CB-CD1 4.38Å; E306-L359 WeakPolarHBondContact OE2-CB 3.24Å; E306-L359 WeakPolarHBondContact OE2-CG 3.2Å; E306-L359 PolarHBondContact OE2-N 3.12Å
307	P	91.9	Very high	93.7	Very high	106 Å²	106	47 Å²	47	69%	0.688	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-11.1	178.3	32	-35.9	0	0	0	114.9	L305	L305-P307 VanDerWaalsContact C-CD 3.46Å
308	V	92.9	Very high	93.8	Very high	51 Å²	51	44.3 Å²	44.3	31%	0.309	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-31.1	-175.1	-174.1	0	0	0	0	112.2	L305 V569 Q572 L573	L305-V308 PolarHBondContact O-N 3.3Å; V308-V569 HydrophobicContact CG1-CG1 4.28Å; V308-Q572 HydrophobicContact CG1-CB 4.01Å; V308-L573 HydrophobicContact CB-CD2 4.28Å; V308-L573 HydrophobicContact CG1-CD2 4.23Å; V308-L573 HydrophobicContact CG2-CD2 3.94Å
309	L	93.8	Very high	93.8	Very high	13 Å²	13	44.9 Å²	44.9	7%	0.068	25%	0.25	C	S	.	.	S	Bend	trans	-72.7	130.9	-177	-68.1	179.5	0	0	0	112.9	L305 K314 V317 L359 V569	L305-L309 HydrophobicContact CB-CD1 3.81Å; L305-L309 HydrophobicContact CB-CG 4.03Å; L305-L309 WeakPolarHBondContact O-CG 3.36Å; L305-L309 PolarHBondContact O-N 2.84Å; L309-K314 HydrophobicContact CB-CG 3.53Å; L309-K314 HydrophobicContact CD1-CG 4.15Å; L309-K314 WeakPolarHBondContact O-CE 3.32Å; L309-V317 HydrophobicContact CD1-CB 4.04Å; L309-V317 HydrophobicContact CD1-CG1 4.1Å; L309-V317 HydrophobicContact CD1-CG2 4.03Å; L309-V317 HydrophobicContact CD2-CG2 4.29Å; L309-L359 HydrophobicContact CD1-CD1 4.17Å; L309-L359 HydrophobicContact CD1-CD2 3.9Å; L309-L359 HydrophobicContact CD1-CG 4.38Å; L309-V569 HydrophobicContact CD2-CB 4.44Å; L309-V569 HydrophobicContact CD2-CG1 4.04Å; L309-V569 HydrophobicContact CD2-CG2 3.62Å
310	S	92.3	Very high	93.8	Very high	63 Å²	63	38.9 Å²	38.9	44%	0.441	23%	0.228	S	C	.	.			trans	-61.6	157.4	165.3	88.4	0	0	0	0	111.4	K312 S313 K314	S310-K312 VanDerWaalsContact C-N 3.26Å; S310-K312 PolarHBondContact O-N 3.5Å; S310-S313 CarbonylContact O-C 3.57Å; S310-S313 WeakPolarHBondContact O-CA 3.27Å; S310-S313 WeakPolarHBondContact O-CB 3.32Å; S310-S313 PolarHBondContact O-N 2.95Å; S310-S313 PolarHBondContact OG-N 3.04Å; S310-S313 VanDerWaalsContact OG-N 3.16Å; S310-S313 PolarHBondContact OG-OG 3.31Å; S310-K314 PolarHBondContact O-N 3.29Å
311	V	89.9	Confident	94	Very high	77 Å²	77	36.1 Å²	36.1	47%	0.467	21%	0.211	S	C	.	.	H	α-helix	trans	-53.5	-41.3	179.2	179.4	0	0	0	0	112.5	K314 E315 N357	V311-K314 PolarHBondContact O-N 3.3Å; V311-E315 PolarHBondContact O-N 2.93Å; V311-N357 HydrophobicContact CG1-CB 4.11Å; V311-N357 HydrophobicContact CG2-CB 4.23Å
312	K	88.6	Confident	94.1	Very high	125 Å²	125	36.1 Å²	36.1	54%	0.543	21%	0.211	S	C	.	.	H	α-helix	trans	-68.1	-37.5	175.4	-65.4	178.5	-178.4	172.7	0	112	S310 E315 E316	S310-K312 VanDerWaalsContact C-N 3.26Å; S310-K312 PolarHBondContact O-N 3.5Å; K312-E315 PolarHBondContact O-N 2.88Å; K312-E316 PolarHBondContact O-N 3.38Å
313	S	91.8	Very high	94.1	Very high	19 Å²	19	37.5 Å²	37.5	13%	0.133	22%	0.217	C	C	.	.	H	α-helix	trans	-69	-35.4	177.3	-47	0	0	0	0	112	S310 E315 V317	S310-S313 CarbonylContact O-C 3.57Å; S310-S313 WeakPolarHBondContact O-CA 3.27Å; S310-S313 WeakPolarHBondContact O-CB 3.32Å; S310-S313 PolarHBondContact O-N 2.95Å; S310-S313 PolarHBondContact OG-N 3.04Å; S310-S313 VanDerWaalsContact OG-N 3.16Å; S310-S313 PolarHBondContact OG-OG 3.31Å; S313-E315 VanDerWaalsContact C-N 3.31Å; S313-E315 PolarHBondContact O-N 3.17Å; S313-V317 VanDerWaalsContact O-CB 3.31Å; S313-V317 WeakPolarHBondContact O-CB 3.3Å; S313-V317 VanDerWaalsContact O-CG2 3.27Å; S313-V317 WeakPolarHBondContact O-CG2 3.37Å; S313-V317 PolarHBondContact O-N 3.04Å
314	K	94.7	Very high	94.2	Very high	25 Å²	25	34.1 Å²	34.1	11%	0.109	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-38.5	173.2	-67.5	-174.3	-169.3	-175.4	0	111.7	E306 L309 S310 V311 A318 N357 L359	E306-K314 WeakPolarHBondContact O-CE 3.29Å; E306-K314 PolarHBondContact O-NZ 3.25Å; E306-K314 VanDerWaalsContact O-NZ 3.14Å; E306-K314 WeakPolarHBondContact OE1-CE 3.34Å; E306-K314 IonicContact OE1-NZ 3.3Å; E306-K314 PolarHBondContact OE1-NZ 2.89Å; L309-K314 HydrophobicContact CB-CG 3.53Å; L309-K314 HydrophobicContact CD1-CG 4.15Å; L309-K314 WeakPolarHBondContact O-CE 3.32Å; S310-K314 PolarHBondContact O-N 3.29Å; V311-K314 PolarHBondContact O-N 3.3Å; K314-A318 WeakPolarHBondContact O-CB 3.48Å; K314-A318 PolarHBondContact O-N 3.37Å; K314-N357 WeakPolarHBondContact CD-O 3.24Å; K314-N357 PolarHBondContact NZ-O 2.97Å; K314-N357 VanDerWaalsContact NZ-O 3.09Å; K314-L359 HydrophobicContact CB-CD2 3.94Å; K314-L359 HydrophobicContact CB-CG 4.46Å; K314-L359 HydrophobicContact CG-CD2 4.14Å; K314-L359 HydrophobicContact CG-CG 4.25Å
315	E	94	Very high	94.3	Very high	62 Å²	62	33.4 Å²	33.4	29%	0.29	18%	0.184	S	C	.	.	H	α-helix	trans	-66.9	-51	176.6	-171.1	168.3	-178.7	0	0	112.1	V311 K312 S313 V317 C319 K362	V311-E315 PolarHBondContact O-N 2.93Å; K312-E315 PolarHBondContact O-N 2.88Å; S313-E315 VanDerWaalsContact C-N 3.31Å; S313-E315 PolarHBondContact O-N 3.17Å; E315-V317 PolarHBondContact O-N 3.25Å; E315-C319 VanDerWaalsContact O-CB 3.25Å; E315-C319 WeakPolarHBondContact O-CB 3.2Å; E315-C319 PolarHBondContact O-N 3.49Å; E315-K362 HydrophobicContact CB-CD 4.46Å
316	E	93.2	Very high	94.3	Very high	53 Å²	53	34.8 Å²	34.8	25%	0.248	19%	0.191	C	C	.	.	H	α-helix	trans	-63.7	-37.1	177.3	-70.7	-171	155.5	0	0	112.3	R239 R275 K312 A320 L565	R239-E316 IonicContact CZ-OE2 3.58Å; R239-E316 IonicContact NE-OE2 2.78Å; R239-E316 PolarHBondContact NE-OE2 3.17Å; R239-E316 IonicContact NH2-OE2 3.76Å; R239-E316 PolarHBondContact NH2-OE2 3.34Å; R275-E316 IonicContact CZ-OE1 3.26Å; R275-E316 IonicContact NH1-OE1 2.79Å; R275-E316 PolarHBondContact NH1-OE1 3.13Å; R275-E316 IonicContact NH2-OE1 2.65Å; R275-E316 PolarHBondContact NH2-OE1 3.31Å; K312-E316 PolarHBondContact O-N 3.38Å; E316-A320 PolarHBondContact O-N 2.89Å; E316-L565 HydrophobicContact CB-CD1 4.03Å; E316-L565 HydrophobicContact CB-CD2 3.95Å; E316-L565 WeakPolarHBondContact O-CD1 3.32Å
317	V	96.4	Very high	94.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-72	-46	177.3	169.3	0	0	0	0	112.4	L305 L309 S313 E315 C319 A320 L321 L359 L562 L565	L305-V317 HydrophobicContact CD1-CG1 4.38Å; L309-V317 HydrophobicContact CD1-CB 4.04Å; L309-V317 HydrophobicContact CD1-CG1 4.1Å; L309-V317 HydrophobicContact CD1-CG2 4.03Å; L309-V317 HydrophobicContact CD2-CG2 4.29Å; S313-V317 VanDerWaalsContact O-CB 3.31Å; S313-V317 WeakPolarHBondContact O-CB 3.3Å; S313-V317 VanDerWaalsContact O-CG2 3.27Å; S313-V317 WeakPolarHBondContact O-CG2 3.37Å; S313-V317 PolarHBondContact O-N 3.04Å; E315-V317 PolarHBondContact O-N 3.25Å; V317-C319 VanDerWaalsContact C-N 3.27Å; V317-C319 PolarHBondContact O-N 3.02Å; V317-A320 PolarHBondContact O-N 3.21Å; V317-L321 HydrophobicContact CG1-CD1 3.78Å; V317-L321 HydrophobicContact CG1-CG 4.32Å; V317-L321 WeakPolarHBondContact O-CB 3.46Å; V317-L321 WeakPolarHBondContact O-CG 3.43Å; V317-L321 PolarHBondContact O-N 2.98Å; V317-L359 HydrophobicContact CB-CD2 4.37Å; V317-L359 HydrophobicContact CG1-CD2 4.13Å; V317-L562 HydrophobicContact CG1-CD1 4.26Å; V317-L565 HydrophobicContact CG2-CB 3.99Å; V317-L565 HydrophobicContact CG2-CD1 3.97Å; V317-L565 HydrophobicContact CG2-CG 4.47Å
318	A	97.1	Very high	94.3	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-63.1	-36.7	177.4	0	0	0	0	0	111.4	K314 L321 V322 L359 K362 A363	K314-A318 WeakPolarHBondContact O-CB 3.48Å; K314-A318 PolarHBondContact O-N 3.37Å; A318-L321 PolarHBondContact O-N 3.45Å; A318-V322 WeakPolarHBondContact O-CB 3.26Å; A318-V322 VanDerWaalsContact O-CG2 3.24Å; A318-V322 WeakPolarHBondContact O-CG2 3.36Å; A318-V322 PolarHBondContact O-N 2.97Å; A318-L359 HydrophobicContact CB-CD2 4.17Å; A318-K362 HydrophobicContact CB-CB 3.74Å; A318-A363 HydrophobicContact CB-CB 4.27Å
319	C	95.8	Very high	94.2	Very high	32 Å²	32	33.3 Å²	33.3	22%	0.216	20%	0.197	C	C	.	.	H	α-helix	trans	-58.1	-55.4	175.2	178.2	0	0	0	0	111.9	E315 V317 L321 V322 H323 E366	E315-C319 VanDerWaalsContact O-CB 3.25Å; E315-C319 WeakPolarHBondContact O-CB 3.2Å; E315-C319 PolarHBondContact O-N 3.49Å; V317-C319 VanDerWaalsContact C-N 3.27Å; V317-C319 PolarHBondContact O-N 3.02Å; C319-L321 PolarHBondContact O-N 3.39Å; C319-V322 PolarHBondContact O-N 3.07Å; C319-H323 PolarHBondContact O-N 3.47Å; C319-H323 VanDerWaalsContact O-N 3.15Å; C319-H323 PolarHBondContact O-ND1 3.19Å; C319-E366 HydrophobicContact CB-CG 4.13Å; C319-E366 PolarHBondContact SG-OE1 3.07Å; C319-E366 VanDerWaalsContact SG-OE1 3.42Å
320	A	96.3	Very high	94.3	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-63.8	-40	-179.7	0	0	0	0	0	112	E316 V317 V322 H323 I324 I561 L562	E316-A320 PolarHBondContact O-N 2.89Å; V317-A320 PolarHBondContact O-N 3.21Å; A320-V322 PolarHBondContact O-N 2.88Å; A320-H323 PolarHBondContact O-N 3.45Å; A320-I324 WeakPolarHBondContact O-CB 3.41Å; A320-I324 WeakPolarHBondContact O-CD1 3.41Å; A320-I324 VanDerWaalsContact O-CG1 3.24Å; A320-I324 WeakPolarHBondContact O-CG1 3.33Å; A320-I324 PolarHBondContact O-N 3.45Å; A320-I561 HydrophobicContact CB-CG2 4.05Å; A320-L562 HydrophobicContact CB-CB 4Å; A320-L562 HydrophobicContact CB-CD1 4.33Å
321	L	97.8	Very high	94.4	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-44.4	175.3	-75.9	173.2	0	0	0	112.4	V294 L301 V317 A318 C319 I324 L325 F334 L562	V294-L321 HydrophobicContact CG1-CD2 3.63Å; L301-L321 HydrophobicContact CD2-CD2 4.01Å; V317-L321 HydrophobicContact CG1-CD1 3.78Å; V317-L321 HydrophobicContact CG1-CG 4.32Å; V317-L321 WeakPolarHBondContact O-CB 3.46Å; V317-L321 WeakPolarHBondContact O-CG 3.43Å; V317-L321 PolarHBondContact O-N 2.98Å; A318-L321 PolarHBondContact O-N 3.45Å; C319-L321 PolarHBondContact O-N 3.39Å; L321-I324 PolarHBondContact O-N 3.02Å; L321-L325 HydrophobicContact CB-CD1 4.46Å; L321-L325 VanDerWaalsContact O-CB 3.24Å; L321-L325 WeakPolarHBondContact O-CB 3.33Å; L321-L325 WeakPolarHBondContact O-CD1 3.42Å; L321-L325 WeakPolarHBondContact O-CG 3.39Å; L321-L325 PolarHBondContact O-N 3.15Å; L321-F334 HydrophobicContact CB-CE1 4.47Å; L321-F334 HydrophobicContact CB-CZ 4.35Å; L321-L562 HydrophobicContact CD2-CD1 4.32Å; L321-L562 HydrophobicContact CD2-CD2 3.72Å; L321-L562 HydrophobicContact CG-CD1 4.2Å; L321-L562 HydrophobicContact CG-CD2 4.39Å
322	V	97.4	Very high	94.5	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.5	-45.6	178	166	0	0	0	0	111.4	A318 C319 A320 Q326 F334 A363 E366 Y367 L370	A318-V322 WeakPolarHBondContact O-CB 3.26Å; A318-V322 VanDerWaalsContact O-CG2 3.24Å; A318-V322 WeakPolarHBondContact O-CG2 3.36Å; A318-V322 PolarHBondContact O-N 2.97Å; C319-V322 PolarHBondContact O-N 3.07Å; A320-V322 PolarHBondContact O-N 2.88Å; V322-Q326 VanDerWaalsContact O-CB 3.27Å; V322-Q326 WeakPolarHBondContact O-CB 3.4Å; V322-Q326 PolarHBondContact O-N 3.37Å; V322-F334 HydrophobicContact CG2-CE1 4Å; V322-A363 HydrophobicContact CG2-CB 3.73Å; V322-A363 WeakPolarHBondContact CG2-O 3.36Å; V322-E366 HydrophobicContact CG2-CB 4.46Å; V322-Y367 HydrophobicContact CG1-CD2 3.84Å; V322-Y367 HydrophobicContact CG1-CG 4.43Å; V322-L370 HydrophobicContact CG1-CD2 3.93Å
323	H	95.6	Very high	94.8	Very high	32 Å²	32	29.6 Å²	29.6	15%	0.148	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-44.9	179.7	-71.5	84.4	0	0	0	112.1	C319 A320 Q326 S327 E366 I553 E558	C319-H323 PolarHBondContact O-N 3.47Å; C319-H323 VanDerWaalsContact O-N 3.15Å; C319-H323 PolarHBondContact O-ND1 3.19Å; A320-H323 PolarHBondContact O-N 3.45Å; H323-Q326 PolarHBondContact O-N 3.41Å; H323-S327 PolarHBondContact O-N 3.31Å; H323-E366 IonicContact CE1-OE1 3.87Å; H323-I553 HydrophobicContact CB-CG2 3.98Å; H323-E558 HydrophobicContact CB-CB 4.41Å; H323-E558 HydrophobicContact CB-CG 3.87Å
324	I	96.7	Very high	95	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.3	-53.1	175.3	-68.8	161.2	0	0	0	110.1	V294 A320 L321 Q326 S327 T328 L555 E558 L559 L562	V294-I324 HydrophobicContact CG1-CG2 4.07Å; A320-I324 WeakPolarHBondContact O-CB 3.41Å; A320-I324 WeakPolarHBondContact O-CD1 3.41Å; A320-I324 VanDerWaalsContact O-CG1 3.24Å; A320-I324 WeakPolarHBondContact O-CG1 3.33Å; A320-I324 PolarHBondContact O-N 3.45Å; L321-I324 PolarHBondContact O-N 3.02Å; I324-Q326 VanDerWaalsContact C-N 3.29Å; I324-Q326 PolarHBondContact O-N 3Å; I324-S327 PolarHBondContact O-N 3.21Å; I324-S327 VanDerWaalsContact O-N 3.09Å; I324-S327 PolarHBondContact O-OG 3.05Å; I324-T328 PolarHBondContact O-N 2.96Å; I324-T328 PolarHBondContact O-OG1 3.26Å; I324-L555 HydrophobicContact CB-CD1 4.31Å; I324-L555 HydrophobicContact CG1-CD1 3.97Å; I324-L555 HydrophobicContact CG2-CD1 4.18Å; I324-E558 HydrophobicContact CD1-CB 4.49Å; I324-E558 HydrophobicContact CG1-CB 3.96Å; I324-L559 HydrophobicContact CD1-CD2 3.81Å; I324-L559 HydrophobicContact CD1-CG 4.23Å; I324-L559 HydrophobicContact CG1-CD2 4.15Å; I324-L559 HydrophobicContact CG1-CG 4.26Å; I324-L559 HydrophobicContact CG2-CD2 4.29Å; I324-L562 HydrophobicContact CD1-CB 3.84Å; I324-L562 HydrophobicContact CD1-CD2 3.53Å; I324-L562 HydrophobicContact CD1-CG 4.32Å
325	L	96.6	Very high	95.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69.9	-24.6	-175.8	-64.5	168.2	0	0	0	112.6	Y298 L321 G329 K330 A331 F334	Y298-L325 HydrophobicContact CD1-CD1 4.39Å; Y298-L325 HydrophobicContact CD1-CD2 4.02Å; Y298-L325 HydrophobicContact CG-CD1 4.27Å; L321-L325 HydrophobicContact CB-CD1 4.46Å; L321-L325 VanDerWaalsContact O-CB 3.24Å; L321-L325 WeakPolarHBondContact O-CB 3.33Å; L321-L325 WeakPolarHBondContact O-CD1 3.42Å; L321-L325 WeakPolarHBondContact O-CG 3.39Å; L321-L325 PolarHBondContact O-N 3.15Å; L325-G329 PolarHBondContact O-N 2.95Å; L325-K330 HydrophobicContact CD2-CB 4.09Å; L325-K330 CarbonylContact O-C 3.42Å; L325-K330 WeakPolarHBondContact O-CA 3.39Å; L325-K330 PolarHBondContact O-N 3.43Å; L325-A331 PolarHBondContact O-N 3.45Å; L325-F334 HydrophobicContact CD1-CB 3.9Å; L325-F334 HydrophobicContact CD1-CD1 3.49Å; L325-F334 VanDerWaalsContact CD1-CD1 3.49Å; L325-F334 HydrophobicContact CD1-CD2 3.91Å; L325-F334 HydrophobicContact CD1-CE1 3.88Å; L325-F334 HydrophobicContact CD1-CE2 4.26Å; L325-F334 HydrophobicContact CD1-CG 3.49Å; L325-F334 VanDerWaalsContact CD1-CG 3.49Å; L325-F334 HydrophobicContact CD1-CZ 4.24Å
326	Q	94.9	Very high	95.1	Very high	31 Å²	31	24.8 Å²	24.8	15%	0.145	15%	0.145	C	C	.	.	H	α-helix	trans	-68.4	-46.3	168.4	177.2	61.1	10.2	0	0	110.5	V322 H323 I324 T328 G329 A331 Y367 L370 I371 F549 I553	V322-Q326 VanDerWaalsContact O-CB 3.27Å; V322-Q326 WeakPolarHBondContact O-CB 3.4Å; V322-Q326 PolarHBondContact O-N 3.37Å; H323-Q326 PolarHBondContact O-N 3.41Å; I324-Q326 VanDerWaalsContact C-N 3.29Å; I324-Q326 PolarHBondContact O-N 3Å; Q326-T328 VanDerWaalsContact C-N 3.3Å; Q326-T328 PolarHBondContact O-N 2.98Å; Q326-G329 PolarHBondContact O-N 2.95Å; Q326-A331 HydrophobicContact CB-CB 4.08Å; Q326-Y367 PolarHBondContact OE1-OH 3.13Å; Q326-L370 HydrophobicContact CB-CD2 4.2Å; Q326-L370 HydrophobicContact CG-CD2 4.25Å; Q326-I371 HydrophobicContact CG-CD1 4.3Å; Q326-F549 HydrophobicContact CG-CD1 4.4Å; Q326-F549 HydrophobicContact CG-CE1 4.46Å; Q326-I553 HydrophobicContact CB-CD1 3.95Å; Q326-I553 HydrophobicContact CG-CD1 3.77Å
327	S	91.6	Very high	95.2	Very high	51 Å²	51	22.6 Å²	22.6	36%	0.357	14%	0.135	S	C	.	.	H	α-helix	trans	-65.4	-29	178.9	76.9	0	0	0	0	113.9	H323 I324 L555	H323-S327 PolarHBondContact O-N 3.31Å; I324-S327 PolarHBondContact O-N 3.21Å; I324-S327 VanDerWaalsContact O-N 3.09Å; I324-S327 PolarHBondContact O-OG 3.05Å; S327-L555 WeakPolarHBondContact OG-CD1 3.37Å
328	T	92.9	Very high	95	Very high	50 Å²	50	23.5 Å²	23.5	31%	0.307	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	6.8	176	64.4	0	0	0	0	113.9	T295 I324 Q326 K330	T295-T328 WeakPolarHBondContact CG2-OG1 3.47Å; T295-T328 PolarHBondContact OG1-OG1 2.78Å; I324-T328 PolarHBondContact O-N 2.96Å; I324-T328 PolarHBondContact O-OG1 3.26Å; Q326-T328 VanDerWaalsContact C-N 3.3Å; Q326-T328 PolarHBondContact O-N 2.98Å; T328-K330 PolarHBondContact O-N 2.88Å
329	G	91.4	Very high	94.8	Very high	62 Å²	62	23.4 Å²	23.4	64%	0.639	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	20.7	174.5	0	0	0	0	0	115.3	L325 Q326	L325-G329 PolarHBondContact O-N 2.95Å; Q326-G329 PolarHBondContact O-N 2.95Å
330	K	94.7	Very high	94.6	Very high	75 Å²	75	22.1 Å²	22.1	33%	0.326	13%	0.129	S	C	.	.			trans	-114	-0.9	-178.3	-76.6	-54	-162.3	-175.7	0	116	T295 L325 T328 K332 D333 F334	T295-K330 HydrophobicContact CG2-CB 4.25Å; T295-K330 HydrophobicContact CG2-CG 3.67Å; L325-K330 HydrophobicContact CD2-CB 4.09Å; L325-K330 CarbonylContact O-C 3.42Å; L325-K330 WeakPolarHBondContact O-CA 3.39Å; L325-K330 PolarHBondContact O-N 3.43Å; T328-K330 PolarHBondContact O-N 2.88Å; K330-K332 VanDerWaalsContact C-N 3.31Å; K330-K332 PolarHBondContact O-N 3.43Å; K330-D333 HydrophobicContact CD-CB 4.39Å; K330-D333 VanDerWaalsContact CD-OD2 3.24Å; K330-D333 WeakPolarHBondContact CD-OD2 3.22Å; K330-D333 WeakPolarHBondContact CE-OD2 3.44Å; K330-D333 IonicContact NZ-OD2 2.98Å; K330-D333 PolarHBondContact NZ-OD2 3.44Å; K330-D333 PolarHBondContact O-N 2.84Å; K330-F334 WeakPolarHBondContact O-CB 3.44Å; K330-F334 PolarHBondContact O-N 2.83Å
331	A	94.4	Very high	94.3	Very high	1 Å²	1	25 Å²	25	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-56.3	-40.3	179.7	0	0	0	0	0	113.6	L325 Q326 F334 L335 Y367	L325-A331 PolarHBondContact O-N 3.45Å; Q326-A331 HydrophobicContact CB-CB 4.08Å; A331-F334 PolarHBondContact O-N 3.13Å; A331-L335 WeakPolarHBondContact O-CB 3.48Å; A331-L335 WeakPolarHBondContact O-CD1 3.42Å; A331-L335 VanDerWaalsContact O-CG 3.26Å; A331-L335 WeakPolarHBondContact O-CG 3.4Å; A331-L335 PolarHBondContact O-N 2.83Å; A331-Y367 HydrophobicContact CB-CD2 4.26Å; A331-Y367 HydrophobicContact CB-CE2 3.57Å
332	K	92.9	Very high	93.9	Very high	70 Å²	70	25.5 Å²	25.5	30%	0.304	15%	0.151	S	C	.	.	H	α-helix	trans	-59.2	-51.5	177.3	179	-172.2	176.5	179.8	0	112.1	K330 S336 E437 V438	K330-K332 VanDerWaalsContact C-N 3.31Å; K330-K332 PolarHBondContact O-N 3.43Å; K332-S336 VanDerWaalsContact O-CB 3.27Å; K332-S336 WeakPolarHBondContact O-CB 3.48Å; K332-S336 PolarHBondContact O-N 2.91Å; K332-S336 PolarHBondContact O-OG 2.87Å; K332-E437 HydrophobicContact CD-CB 4.05Å; K332-E437 WeakPolarHBondContact CD-OE2 3.33Å; K332-E437 WeakPolarHBondContact CE-O 3.12Å; K332-E437 WeakPolarHBondContact CE-OE2 3.46Å; K332-E437 IonicContact NZ-OE2 3.15Å; K332-E437 PolarHBondContact NZ-OE2 3.03Å; K332-V438 HydrophobicContact CB-CG2 4.18Å; K332-V438 HydrophobicContact CG-CG2 3.97Å
333	D	94.6	Very high	93.5	Very high	54 Å²	54	25.6 Å²	25.6	29%	0.289	15%	0.152	S	C	.	.	H	α-helix	trans	-59.5	-52.7	178	-66.3	-7.8	0	0	0	109.4	K330 L335 S336 D337	K330-D333 HydrophobicContact CD-CB 4.39Å; K330-D333 VanDerWaalsContact CD-OD2 3.24Å; K330-D333 WeakPolarHBondContact CD-OD2 3.22Å; K330-D333 WeakPolarHBondContact CE-OD2 3.44Å; K330-D333 IonicContact NZ-OD2 2.98Å; K330-D333 PolarHBondContact NZ-OD2 3.44Å; K330-D333 PolarHBondContact O-N 2.84Å; D333-L335 PolarHBondContact O-N 2.87Å; D333-S336 PolarHBondContact O-N 3.26Å; D333-D337 WeakPolarHBondContact O-CB 3.42Å; D333-D337 PolarHBondContact O-N 2.95Å
334	F	96.8	Very high	93.1	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.009	16%	0.164	C	C	.	.	H	α-helix	trans	-52.1	-48.6	179.3	168.5	-126.5	0	0	0	113.4	Y298 L321 V322 L325 K330 A331 D337 M338 A363	Y298-F334 HydrophobicContact CD2-CB 4.19Å; Y298-F334 AromaticContact CD2-CD2 3.49Å; Y298-F334 HydrophobicContact CD2-CD2 3.49Å; Y298-F334 VanDerWaalsContact CD2-CD2 3.49Å; Y298-F334 HydrophobicContact CD2-CE2 4.31Å; Y298-F334 HydrophobicContact CD2-CG 4.26Å; Y298-F334 HydrophobicContact CE2-CB 4.04Å; Y298-F334 HydrophobicContact CE2-CD2 4.05Å; Y298-F334 HydrophobicContact CG-CD2 4.01Å; L321-F334 HydrophobicContact CB-CE1 4.47Å; L321-F334 HydrophobicContact CB-CZ 4.35Å; V322-F334 HydrophobicContact CG2-CE1 4Å; L325-F334 HydrophobicContact CD1-CB 3.9Å; L325-F334 HydrophobicContact CD1-CD1 3.49Å; L325-F334 VanDerWaalsContact CD1-CD1 3.49Å; L325-F334 HydrophobicContact CD1-CD2 3.91Å; L325-F334 HydrophobicContact CD1-CE1 3.88Å; L325-F334 HydrophobicContact CD1-CE2 4.26Å; L325-F334 HydrophobicContact CD1-CG 3.49Å; L325-F334 VanDerWaalsContact CD1-CG 3.49Å; L325-F334 HydrophobicContact CD1-CZ 4.24Å; K330-F334 WeakPolarHBondContact O-CB 3.44Å; K330-F334 PolarHBondContact O-N 2.83Å; A331-F334 PolarHBondContact O-N 3.13Å; F334-D337 PolarHBondContact O-N 3.49Å; F334-M338 HydrophobicContact CD2-CG 3.62Å; F334-M338 HydrophobicContact CE2-CG 3.37Å; F334-M338 HydrophobicContact CE2-SD 4.03Å; F334-M338 HydrophobicContact CZ-CG 4.15Å; F334-M338 WeakPolarHBondContact O-CB 3.33Å; F334-M338 VanDerWaalsContact O-CG 3.25Å; F334-M338 WeakPolarHBondContact O-CG 3.44Å; F334-M338 PolarHBondContact O-N 2.8Å; F334-A363 HydrophobicContact CE1-CB 3.72Å; F334-A363 HydrophobicContact CZ-CB 3.87Å
335	L	96.1	Very high	92.6	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-75	-34.1	-178.1	-66.2	164.5	0	0	0	112.4	A331 D333 D337 A339 A363 I364 Y367 V438 W442	A331-L335 WeakPolarHBondContact O-CB 3.48Å; A331-L335 WeakPolarHBondContact O-CD1 3.42Å; A331-L335 VanDerWaalsContact O-CG 3.26Å; A331-L335 WeakPolarHBondContact O-CG 3.4Å; A331-L335 PolarHBondContact O-N 2.83Å; D333-L335 PolarHBondContact O-N 2.87Å; L335-D337 VanDerWaalsContact C-N 3.27Å; L335-A339 WeakPolarHBondContact O-CB 3.44Å; L335-A339 PolarHBondContact O-N 3.2Å; L335-A363 HydrophobicContact CD2-CB 3.7Å; L335-I364 HydrophobicContact CD2-CG1 3.97Å; L335-Y367 HydrophobicContact CD1-CD1 3.17Å; L335-Y367 HydrophobicContact CD1-CD2 3.73Å; L335-Y367 HydrophobicContact CD1-CE1 3.59Å; L335-Y367 HydrophobicContact CD1-CE2 4.1Å; L335-Y367 HydrophobicContact CD1-CG 3.21Å; L335-V438 HydrophobicContact CB-CG1 4.2Å; L335-W442 PolarHBondContact O-NE1 2.8Å
336	S	94.4	Very high	91.9	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-66.6	-32.9	171.9	-54	0	0	0	0	111.7	K332 D333 M340 S441 R445	K332-S336 VanDerWaalsContact O-CB 3.27Å; K332-S336 WeakPolarHBondContact O-CB 3.48Å; K332-S336 PolarHBondContact O-N 2.91Å; K332-S336 PolarHBondContact O-OG 2.87Å; D333-S336 PolarHBondContact O-N 3.26Å; S336-M340 VanDerWaalsContact O-CG 3.27Å; S336-M340 WeakPolarHBondContact O-CG 3.33Å; S336-M340 PolarHBondContact O-N 2.91Å; S336-S441 PolarHBondContact OG-OG 3.16Å; S336-R445 PolarHBondContact O-NH1 2.97Å
337	D	94.2	Very high	90.9	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.043	20%	0.2	C	C	.	.	H	α-helix	trans	-77.3	-50.6	179.8	-70.8	-6.8	0	0	0	111.4	Y298 R299 D333 F334 L335 A339 M340 C341 R445	Y298-D337 HydrophobicContact CE2-CB 4.4Å; Y298-D337 PolarHBondContact OH-OD2 3.37Å; Y298-D337 VanDerWaalsContact OH-OD2 3.14Å; R299-D337 IonicContact CZ-OD1 3.78Å; R299-D337 IonicContact CZ-OD2 3.8Å; R299-D337 IonicContact NE-OD2 2.72Å; R299-D337 PolarHBondContact NE-OD2 3.05Å; R299-D337 IonicContact NH2-OD1 3.4Å; R299-D337 PolarHBondContact NH2-OD1 3.49Å; R299-D337 IonicContact NH2-OD2 3.43Å; R299-D337 PolarHBondContact NH2-OD2 3.02Å; D333-D337 WeakPolarHBondContact O-CB 3.42Å; D333-D337 PolarHBondContact O-N 2.95Å; F334-D337 PolarHBondContact O-N 3.49Å; L335-D337 VanDerWaalsContact C-N 3.27Å; D337-A339 PolarHBondContact O-N 2.79Å; D337-M340 PolarHBondContact O-N 3.37Å; D337-C341 PolarHBondContact O-N 2.85Å; D337-C341 PolarHBondContact O-SG 2.86Å; D337-C341 VanDerWaalsContact O-SG 3.33Å; D337-R445 IonicContact OD1-CZ 2.69Å; D337-R445 IonicContact OD1-NH1 3.2Å; D337-R445 PolarHBondContact OD1-NH1 3.05Å; D337-R445 IonicContact OD1-NH2 3.04Å; D337-R445 PolarHBondContact OD1-NH2 2.83Å
338	M	93.7	Very high	90.2	Very high	19 Å²	19	41.2 Å²	41.2	9%	0.094	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-38.6	177.6	-68.9	-60.1	-62.7	0	0	112.2	C302 F334 C341 E342 L359 A360	C302-M338 HydrophobicContact CB-CE 3.8Å; C302-M338 HydrophobicContact CB-SD 3.85Å; F334-M338 HydrophobicContact CD2-CG 3.62Å; F334-M338 HydrophobicContact CE2-CG 3.37Å; F334-M338 HydrophobicContact CE2-SD 4.03Å; F334-M338 HydrophobicContact CZ-CG 4.15Å; F334-M338 WeakPolarHBondContact O-CB 3.33Å; F334-M338 VanDerWaalsContact O-CG 3.25Å; F334-M338 WeakPolarHBondContact O-CG 3.44Å; F334-M338 PolarHBondContact O-N 2.8Å; M338-C341 PolarHBondContact O-N 3.17Å; M338-E342 PolarHBondContact O-N 3.43Å; M338-L359 HydrophobicContact CE-CB 4.18Å; M338-A360 HydrophobicContact CB-CB 3.86Å; M338-A360 HydrophobicContact CE-CB 3.99Å
339	A	91.9	Very high	89.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-47	175.6	0	0	0	0	0	112.1	L335 D337 C341 E342 V343 F354 I364 W442	L335-A339 WeakPolarHBondContact O-CB 3.44Å; L335-A339 PolarHBondContact O-N 3.2Å; D337-A339 PolarHBondContact O-N 2.79Å; A339-C341 VanDerWaalsContact C-N 3.34Å; A339-C341 PolarHBondContact O-N 2.92Å; A339-E342 PolarHBondContact O-N 2.89Å; A339-V343 PolarHBondContact O-N 3.13Å; A339-V343 VanDerWaalsContact O-N 3.14Å; A339-F354 HydrophobicContact CB-CZ 3.83Å; A339-I364 HydrophobicContact CB-CD1 4.42Å; A339-W442 HydrophobicContact CB-CD2 4.4Å; A339-W442 HydrophobicContact CB-CZ2 3.92Å; A339-W442 VanDerWaalsContact CB-NE1 3.28Å
340	M	91.6	Very high	89	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.02	22%	0.219	C	C	.	.	H	α-helix	trans	-67.9	-33.4	178.3	-67.6	-57.4	102	0	0	112.2	S336 D337 E342 V343 D344 W442 R445 L458	S336-M340 VanDerWaalsContact O-CG 3.27Å; S336-M340 WeakPolarHBondContact O-CG 3.33Å; S336-M340 PolarHBondContact O-N 2.91Å; D337-M340 PolarHBondContact O-N 3.37Å; M340-E342 VanDerWaalsContact C-N 3.26Å; M340-E342 PolarHBondContact O-N 2.9Å; M340-V343 HydrophobicContact CE-CG2 4.03Å; M340-V343 PolarHBondContact O-N 2.99Å; M340-V343 VanDerWaalsContact O-N 3.15Å; M340-D344 WeakPolarHBondContact O-CB 3.27Å; M340-D344 PolarHBondContact O-N 2.9Å; M340-W442 HydrophobicContact CE-CB 4.38Å; M340-W442 HydrophobicContact CE-CG 4.46Å; M340-R445 HydrophobicContact CG-CB 3.92Å; M340-R445 HydrophobicContact SD-CB 3.62Å; M340-L458 HydrophobicContact CE-CD1 4.22Å
341	C	89.8	Confident	88.2	Confident	61 Å²	61	48 Å²	48	41%	0.412	23%	0.228	S	C	.	.	H	α-helix	trans	-60.6	-32.4	172.7	-73.2	0	0	0	0	113.3	D337 M338 A339 R345	D337-C341 PolarHBondContact O-N 2.85Å; D337-C341 PolarHBondContact O-SG 2.86Å; D337-C341 VanDerWaalsContact O-SG 3.33Å; M338-C341 PolarHBondContact O-N 3.17Å; A339-C341 VanDerWaalsContact C-N 3.34Å; A339-C341 PolarHBondContact O-N 2.92Å; C341-R345 WeakPolarHBondContact O-CB 3.39Å; C341-R345 PolarHBondContact O-N 3.06Å; C341-R345 VanDerWaalsContact O-N 3.12Å
342	E	88.9	Confident	87.5	Confident	12 Å²	12	50.1 Å²	50.1	6%	0.056	24%	0.239	C	C	.	.	H	α-helix	trans	-75.5	-37.5	172.1	-63.2	-71.2	-172.6	0	0	112.5	M338 A339 M340 R345 F346 F354 T358 A360	M338-E342 PolarHBondContact O-N 3.43Å; A339-E342 PolarHBondContact O-N 2.89Å; M340-E342 VanDerWaalsContact C-N 3.26Å; M340-E342 PolarHBondContact O-N 2.9Å; E342-R345 PolarHBondContact O-N 2.87Å; E342-R345 IonicContact OE2-NH1 3.56Å; E342-R345 PolarHBondContact OE2-NH1 2.99Å; E342-F346 WeakPolarHBondContact O-CD2 3.49Å; E342-F346 PolarHBondContact O-N 2.8Å; E342-F346 VanDerWaalsContact O-N 3.08Å; E342-F354 HydrophobicContact CB-CD1 4.22Å; E342-F354 HydrophobicContact CB-CE1 3.93Å; E342-F354 HydrophobicContact CG-CD1 4.31Å; E342-F354 HydrophobicContact CG-CE1 4.02Å; E342-T358 WeakPolarHBondContact OE1-CB 3.35Å; E342-T358 VanDerWaalsContact OE1-CG2 3.24Å; E342-T358 WeakPolarHBondContact OE1-CG2 3.37Å; E342-T358 PolarHBondContact OE1-OG1 2.91Å; E342-A360 HydrophobicContact CG-CB 3.6Å
343	V	89.4	Confident	87	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-48.1	174.8	174.2	0	0	0	0	110.5	A339 M340 R345 F346 I347 I353 I454 L458	A339-V343 PolarHBondContact O-N 3.13Å; A339-V343 VanDerWaalsContact O-N 3.14Å; M340-V343 HydrophobicContact CE-CG2 4.03Å; M340-V343 PolarHBondContact O-N 2.99Å; M340-V343 VanDerWaalsContact O-N 3.15Å; V343-R345 VanDerWaalsContact C-N 3.32Å; V343-R345 PolarHBondContact O-N 2.95Å; V343-F346 CarbonylContact O-C 3.55Å; V343-F346 PolarHBondContact O-N 2.68Å; V343-I347 WeakPolarHBondContact O-CA 3.43Å; V343-I347 PolarHBondContact O-N 2.9Å; V343-I353 HydrophobicContact CG2-CD1 4.42Å; V343-I353 HydrophobicContact CG2-CG2 4.37Å; V343-I454 HydrophobicContact CG1-CD1 4.5Å; V343-I454 HydrophobicContact CG2-CG2 4.43Å; V343-L458 HydrophobicContact CG2-CD1 3.4Å
344	D	87.5	Confident	86.4	Confident	76 Å²	76	45.9 Å²	45.9	41%	0.406	22%	0.219	S	C	.	.	H	α-helix	trans	-66.6	-33.9	179.6	-63.6	-25.7	0	0	0	111.5	M340 R449	M340-D344 WeakPolarHBondContact O-CB 3.27Å; M340-D344 PolarHBondContact O-N 2.9Å; D344-R449 IonicContact OD1-CZ 3.21Å; D344-R449 IonicContact OD1-NE 3.7Å; D344-R449 PolarHBondContact OD1-NE 2.83Å; D344-R449 IonicContact OD1-NH2 2.83Å; D344-R449 PolarHBondContact OD1-NH2 2.83Å; D344-R449 VanDerWaalsContact OD1-NH2 3.15Å; D344-R449 IonicContact OD2-CZ 2.78Å; D344-R449 IonicContact OD2-NE 3.74Å; D344-R449 IonicContact OD2-NH2 3.79Å; D344-R449 PolarHBondContact OD2-NH2 2.82Å
345	R	85.9	Confident	85.7	Confident	129 Å²	129	54.2 Å²	54.2	49%	0.487	25%	0.25	S	S	.	.	H	α-helix	trans	-69.8	-26.6	175	177.2	178	173.9	-125.2	-9.6	113.7	C341 E342 V343 E356	C341-R345 WeakPolarHBondContact O-CB 3.39Å; C341-R345 PolarHBondContact O-N 3.06Å; C341-R345 VanDerWaalsContact O-N 3.12Å; E342-R345 PolarHBondContact O-N 2.87Å; E342-R345 IonicContact OE2-NH1 3.56Å; E342-R345 PolarHBondContact OE2-NH1 2.99Å; V343-R345 VanDerWaalsContact C-N 3.32Å; V343-R345 PolarHBondContact O-N 2.95Å; R345-E356 IonicContact CZ-OE2 3.46Å; R345-E356 IonicContact NH1-OE2 3.3Å; R345-E356 PolarHBondContact NH1-OE2 2.91Å; R345-E356 IonicContact NH2-OE1 2.61Å; R345-E356 IonicContact NH2-OE2 2.7Å; R345-E356 PolarHBondContact NH2-OE2 2.8Å
346	F	81.6	Confident	85	Confident	18 Å²	18	57.8 Å²	57.8	8%	0.079	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	28.4	-175.5	-67	-65.3	0	0	0	113.7	E342 V343 D348 R349 E350 L352 I353 E356	E342-F346 WeakPolarHBondContact O-CD2 3.49Å; E342-F346 PolarHBondContact O-N 2.8Å; E342-F346 VanDerWaalsContact O-N 3.08Å; V343-F346 CarbonylContact O-C 3.55Å; V343-F346 PolarHBondContact O-N 2.68Å; F346-D348 PolarHBondContact O-N 3.01Å; F346-D348 VanDerWaalsContact O-N 3.15Å; F346-R349 HydrophobicContact CD1-CB 4.43Å; F346-R349 CarbonylContact O-C 3.45Å; F346-R349 WeakPolarHBondContact O-CA 3.45Å; F346-R349 PolarHBondContact O-N 2.91Å; F346-E350 PolarHBondContact O-N 2.83Å; F346-L352 HydrophobicContact CD1-CB 3.9Å; F346-L352 HydrophobicContact CD1-CD1 4.02Å; F346-L352 HydrophobicContact CE1-CB 4.1Å; F346-L352 HydrophobicContact CE1-CD1 3.94Å; F346-L352 HydrophobicContact CG-CB 4.19Å; F346-I353 HydrophobicContact CB-CG1 3.75Å; F346-E356 HydrophobicContact CZ-CG 4.35Å; F346-E356 WeakPolarHBondContact CZ-OE1 3.06Å
347	I	74.6	Confident	84.7	Confident	64 Å²	64	61.5 Å²	61.5	33%	0.328	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-31.7	-174.2	-165.5	165.3	0	0	0	113.8	V343 R451	V343-I347 WeakPolarHBondContact O-CA 3.43Å; V343-I347 PolarHBondContact O-N 2.9Å; I347-R451 PolarHBondContact O-NH2 2.88Å
348	D	77.1	Confident	84.6	Confident	154 Å²	154	61.2 Å²	61.2	82%	0.824	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.6	175.3	-52.5	-45.6	0	0	0	113.6	F346	F346-D348 PolarHBondContact O-N 3.01Å; F346-D348 VanDerWaalsContact O-N 3.15Å
349	R	81.6	Confident	84.7	Confident	155 Å²	155	60.4 Å²	60.4	59%	0.585	28%	0.281	S	S	*	.			trans	-137.2	52.8	-172.1	-60.2	-171.2	-174.8	-173.1	2.5	111.1	F346 H351 L352	F346-R349 HydrophobicContact CD1-CB 4.43Å; F346-R349 CarbonylContact O-C 3.45Å; F346-R349 WeakPolarHBondContact O-CA 3.45Å; F346-R349 PolarHBondContact O-N 2.91Å; R349-H351 PolarHBondContact O-N 2.94Å; R349-L352 HydrophobicContact CB-CD1 3.87Å; R349-L352 HydrophobicContact CB-CG 4.15Å; R349-L352 HydrophobicContact CG-CD1 4.45Å; R349-L352 WeakPolarHBondContact O-CB 3.48Å; R349-L352 PolarHBondContact O-N 2.61Å
350	E	77.8	Confident	84.8	Confident	62 Å²	62	60.4 Å²	60.4	29%	0.29	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-45.5	-37.6	-177.2	-55.2	-179.6	166.9	0	0	114.1	F346 L352 I353 R451 I454 R457	F346-E350 PolarHBondContact O-N 2.83Å; E350-L352 PolarHBondContact O-N 2.87Å; E350-I353 HydrophobicContact CB-CD1 4.43Å; E350-I353 WeakPolarHBondContact O-CB 3.42Å; E350-I353 PolarHBondContact O-N 3.07Å; E350-R451 IonicContact OE1-CZ 3.11Å; E350-R451 IonicContact OE1-NE 3.2Å; E350-R451 PolarHBondContact OE1-NE 3.22Å; E350-R451 IonicContact OE1-NH2 3.66Å; E350-R451 PolarHBondContact OE1-NH2 3.3Å; E350-I454 HydrophobicContact CG-CD1 4.29Å; E350-R457 VanDerWaalsContact CD-NH2 3.32Å; E350-R457 IonicContact OE1-NH2 2.65Å; E350-R457 IonicContact OE2-CZ 2.69Å; E350-R457 VanDerWaalsContact OE2-CZ 3.23Å; E350-R457 IonicContact OE2-NH1 2.81Å; E350-R457 PolarHBondContact OE2-NH1 2.86Å; E350-R457 IonicContact OE2-NH2 3.47Å; E350-R457 PolarHBondContact OE2-NH2 2.86Å
351	H	76.6	Confident	84.8	Confident	114 Å²	114	60.3 Å²	60.3	53%	0.528	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-67.7	-0.8	179.4	68	-95.4	0	0	0	114.5	R349 R355	R349-H351 PolarHBondContact O-N 2.94Å; H351-R355 WeakPolarHBondContact O-CD 3.46Å; H351-R355 PolarHBondContact O-NE 2.96Å; H351-R355 PolarHBondContact O-NH1 3.11Å
352	L	80.1	Confident	85.1	Confident	45 Å²	45	58.3 Å²	58.3	24%	0.236	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-106.1	-16.8	171.4	-57	-178.6	0	0	0	112.8	F346 R349 E350 F354 R355	F346-L352 HydrophobicContact CD1-CB 3.9Å; F346-L352 HydrophobicContact CD1-CD1 4.02Å; F346-L352 HydrophobicContact CE1-CB 4.1Å; F346-L352 HydrophobicContact CE1-CD1 3.94Å; F346-L352 HydrophobicContact CG-CB 4.19Å; R349-L352 HydrophobicContact CB-CD1 3.87Å; R349-L352 HydrophobicContact CB-CG 4.15Å; R349-L352 HydrophobicContact CG-CD1 4.45Å; R349-L352 WeakPolarHBondContact O-CB 3.48Å; R349-L352 PolarHBondContact O-N 2.61Å; E350-L352 PolarHBondContact O-N 2.87Å; L352-F354 PolarHBondContact O-N 2.91Å; L352-R355 PolarHBondContact O-N 2.9Å
353	I	82.9	Confident	85.5	Confident	22 Å²	22	57.8 Å²	57.8	11%	0.113	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	125.2	177.3	-61.8	171.9	0	0	0	108.4	V343 F346 E350 R355 I454 L458	V343-I353 HydrophobicContact CG2-CD1 4.42Å; V343-I353 HydrophobicContact CG2-CG2 4.37Å; F346-I353 HydrophobicContact CB-CG1 3.75Å; E350-I353 HydrophobicContact CB-CD1 4.43Å; E350-I353 WeakPolarHBondContact O-CB 3.42Å; E350-I353 PolarHBondContact O-N 3.07Å; I353-R355 PolarHBondContact O-N 2.87Å; I353-I454 HydrophobicContact CD1-CD1 4.22Å; I353-I454 HydrophobicContact CD1-CG2 4.11Å; I353-L458 HydrophobicContact CG2-CD1 4.42Å
354	F	82.1	Confident	85.7	Confident	13 Å²	13	57.8 Å²	57.8	6%	0.057	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	38.4	-174.4	-60.5	-8.3	0	0	0	114.3	A339 E342 L352 T361 I364 L458 S462 R466	A339-F354 HydrophobicContact CB-CZ 3.83Å; E342-F354 HydrophobicContact CB-CD1 4.22Å; E342-F354 HydrophobicContact CB-CE1 3.93Å; E342-F354 HydrophobicContact CG-CD1 4.31Å; E342-F354 HydrophobicContact CG-CE1 4.02Å; L352-F354 PolarHBondContact O-N 2.91Å; F354-T361 HydrophobicContact CB-CG2 4.14Å; F354-T361 HydrophobicContact CD1-CG2 3.83Å; F354-T361 HydrophobicContact CG-CG2 4.16Å; F354-I364 HydrophobicContact CE1-CD1 3.99Å; F354-I364 HydrophobicContact CE2-CD1 3.58Å; F354-I364 HydrophobicContact CZ-CD1 3.27Å; F354-L458 HydrophobicContact CD2-CD2 4.42Å; F354-L458 HydrophobicContact CD2-CG 4.08Å; F354-L458 HydrophobicContact CE2-CD1 4.27Å; F354-L458 HydrophobicContact CE2-CD2 3.48Å; F354-L458 VanDerWaalsContact CE2-CD2 3.48Å; F354-L458 HydrophobicContact CE2-CG 3.51Å; F354-L458 HydrophobicContact CZ-CD1 4.24Å; F354-L458 HydrophobicContact CZ-CD2 3.93Å; F354-L458 HydrophobicContact CZ-CG 3.97Å; F354-S462 WeakPolarHBondContact CE2-OG 3.5Å; F354-R466 PolarHBondContact O-NH2 2.97Å
355	R	81.2	Confident	86.1	Confident	177 Å²	177	55.4 Å²	55.4	67%	0.668	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-22.2	163.2	-64.3	-156.6	177	147.5	-10.9	114.3	H351 L352 I353	H351-R355 WeakPolarHBondContact O-CD 3.46Å; H351-R355 PolarHBondContact O-NE 2.96Å; H351-R355 PolarHBondContact O-NH1 3.11Å; L352-R355 PolarHBondContact O-N 2.9Å; I353-R355 PolarHBondContact O-N 2.87Å
356	E	82.4	Confident	86.5	Confident	76 Å²	76	50.8 Å²	50.8	36%	0.355	23%	0.233	S	C	.	.	S	Bend	trans	-73.9	165	172.3	-68.6	-168.7	170.6	0	0	112.7	R345 F346 T358 T361	R345-E356 IonicContact CZ-OE2 3.46Å; R345-E356 IonicContact NH1-OE2 3.3Å; R345-E356 PolarHBondContact NH1-OE2 2.91Å; R345-E356 IonicContact NH2-OE1 2.61Å; R345-E356 IonicContact NH2-OE2 2.7Å; R345-E356 PolarHBondContact NH2-OE2 2.8Å; F346-E356 HydrophobicContact CZ-CG 4.35Å; F346-E356 WeakPolarHBondContact CZ-OE1 3.06Å; E356-T358 HydrophobicContact CB-CG2 3.75Å; E356-T361 PolarHBondContact O-OG1 3.12Å
357	N	88.1	Confident	87.2	Confident	80 Å²	80	50.3 Å²	50.3	43%	0.428	23%	0.231	S	C	.	.			trans	-96.4	85.6	172.1	-78.9	-67.9	0	0	0	110.1	V311 K314	V311-N357 HydrophobicContact CG1-CB 4.11Å; V311-N357 HydrophobicContact CG2-CB 4.23Å; K314-N357 WeakPolarHBondContact CD-O 3.24Å; K314-N357 PolarHBondContact NZ-O 2.97Å; K314-N357 VanDerWaalsContact NZ-O 3.09Å
358	T	92.3	Very high	88.2	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	22%	0.216	C	C	.	.			trans	-118.1	162.1	-176.2	71.5	0	0	0	0	112.5	E306 E342 E356 A360 T361 K362	E306-T358 VanDerWaalsContact OE1-CA 3.23Å; E306-T358 WeakPolarHBondContact OE1-CA 3.47Å; E306-T358 VanDerWaalsContact OE1-CB 3.26Å; E306-T358 WeakPolarHBondContact OE1-CB 3.38Å; E342-T358 WeakPolarHBondContact OE1-CB 3.35Å; E342-T358 VanDerWaalsContact OE1-CG2 3.24Å; E342-T358 WeakPolarHBondContact OE1-CG2 3.37Å; E342-T358 PolarHBondContact OE1-OG1 2.91Å; E356-T358 HydrophobicContact CB-CG2 3.75Å; T358-A360 PolarHBondContact O-N 3.44Å; T358-T361 PolarHBondContact N-OG1 3.27Å; T358-T361 VanDerWaalsContact N-OG1 3.14Å; T358-T361 PolarHBondContact O-N 3.48Å; T358-T361 VanDerWaalsContact O-N 3.17Å; T358-T361 PolarHBondContact O-OG1 3.26Å; T358-T361 PolarHBondContact OG1-N 2.96Å; T358-K362 PolarHBondContact O-N 2.77Å
359	L	94.6	Very high	88.9	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-56.4	-35.8	174.5	-73.6	169.7	0	0	0	112	C302 L305 E306 L309 K314 V317 A318 M338 K362 A363	C302-L359 HydrophobicContact CB-CD1 3.94Å; L305-L359 HydrophobicContact CB-CD1 4.25Å; E306-L359 HydrophobicContact CB-CD1 4.38Å; E306-L359 WeakPolarHBondContact OE2-CB 3.24Å; E306-L359 WeakPolarHBondContact OE2-CG 3.2Å; E306-L359 PolarHBondContact OE2-N 3.12Å; L309-L359 HydrophobicContact CD1-CD1 4.17Å; L309-L359 HydrophobicContact CD1-CD2 3.9Å; L309-L359 HydrophobicContact CD1-CG 4.38Å; K314-L359 HydrophobicContact CB-CD2 3.94Å; K314-L359 HydrophobicContact CB-CG 4.46Å; K314-L359 HydrophobicContact CG-CD2 4.14Å; K314-L359 HydrophobicContact CG-CG 4.25Å; V317-L359 HydrophobicContact CB-CD2 4.37Å; V317-L359 HydrophobicContact CG1-CD2 4.13Å; A318-L359 HydrophobicContact CB-CD2 4.17Å; M338-L359 HydrophobicContact CE-CB 4.18Å; L359-K362 PolarHBondContact O-N 2.69Å; L359-A363 VanDerWaalsContact O-CB 3.23Å; L359-A363 WeakPolarHBondContact O-CB 3.45Å; L359-A363 PolarHBondContact O-N 3.46Å
360	A	94	Very high	89.4	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.6	-52.6	175.4	0	0	0	0	0	111.1	M338 E342 T358 K362 A363 I364	M338-A360 HydrophobicContact CB-CB 3.86Å; M338-A360 HydrophobicContact CE-CB 3.99Å; E342-A360 HydrophobicContact CG-CB 3.6Å; T358-A360 PolarHBondContact O-N 3.44Å; A360-K362 VanDerWaalsContact C-N 3.32Å; A360-K362 PolarHBondContact O-N 2.96Å; A360-A363 PolarHBondContact O-N 3.21Å; A360-I364 WeakPolarHBondContact O-CG1 3.28Å; A360-I364 PolarHBondContact O-N 2.97Å
361	T	93.2	Very high	90	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.012	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-34.6	-178.5	63.4	0	0	0	0	113.1	F354 E356 T358 E365	F354-T361 HydrophobicContact CB-CG2 4.14Å; F354-T361 HydrophobicContact CD1-CG2 3.83Å; F354-T361 HydrophobicContact CG-CG2 4.16Å; E356-T361 PolarHBondContact O-OG1 3.12Å; T358-T361 PolarHBondContact N-OG1 3.27Å; T358-T361 VanDerWaalsContact N-OG1 3.14Å; T358-T361 PolarHBondContact O-N 3.48Å; T358-T361 VanDerWaalsContact O-N 3.17Å; T358-T361 PolarHBondContact O-OG1 3.26Å; T358-T361 PolarHBondContact OG1-N 2.96Å; T361-E365 PolarHBondContact O-N 3.11Å
362	K	95.3	Very high	90.7	Very high	20 Å²	20	29.3 Å²	29.3	9%	0.087	13%	0.134	C	C	.	.	H	α-helix	trans	-76.6	-31.9	176.7	-67.3	-57.7	-178.2	179.2	0	113.6	E315 A318 T358 L359 A360 E365 E366	E315-K362 HydrophobicContact CB-CD 4.46Å; A318-K362 HydrophobicContact CB-CB 3.74Å; T358-K362 PolarHBondContact O-N 2.77Å; L359-K362 PolarHBondContact O-N 2.69Å; A360-K362 VanDerWaalsContact C-N 3.32Å; A360-K362 PolarHBondContact O-N 2.96Å; K362-E365 VanDerWaalsContact CD-OE2 3.24Å; K362-E365 WeakPolarHBondContact CD-OE2 3.18Å; K362-E365 IonicContact NZ-OE1 2.74Å; K362-E365 IonicContact NZ-OE2 2.74Å; K362-E365 PolarHBondContact NZ-OE2 3.43Å; K362-E366 PolarHBondContact O-N 3.16Å
363	A	96.7	Very high	91.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.5	-40.1	171.8	0	0	0	0	0	111.5	A318 V322 F334 L335 L359 A360 E366 Y367	A318-A363 HydrophobicContact CB-CB 4.27Å; V322-A363 HydrophobicContact CG2-CB 3.73Å; V322-A363 WeakPolarHBondContact CG2-O 3.36Å; F334-A363 HydrophobicContact CE1-CB 3.72Å; F334-A363 HydrophobicContact CZ-CB 3.87Å; L335-A363 HydrophobicContact CD2-CB 3.7Å; L359-A363 VanDerWaalsContact O-CB 3.23Å; L359-A363 WeakPolarHBondContact O-CB 3.45Å; L359-A363 PolarHBondContact O-N 3.46Å; A360-A363 PolarHBondContact O-N 3.21Å; A363-E366 PolarHBondContact O-N 2.95Å; A363-Y367 WeakPolarHBondContact O-CB 3.28Å; A363-Y367 PolarHBondContact O-N 3.18Å
364	I	95.3	Very high	91.3	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-65	-46.1	175.1	-68.2	165.8	0	0	0	110.9	L335 A339 F354 A360 E366 Y367 L368 W442	L335-I364 HydrophobicContact CD2-CG1 3.97Å; A339-I364 HydrophobicContact CB-CD1 4.42Å; F354-I364 HydrophobicContact CE1-CD1 3.99Å; F354-I364 HydrophobicContact CE2-CD1 3.58Å; F354-I364 HydrophobicContact CZ-CD1 3.27Å; A360-I364 WeakPolarHBondContact O-CG1 3.28Å; A360-I364 PolarHBondContact O-N 2.97Å; I364-E366 VanDerWaalsContact C-N 3.34Å; I364-E366 PolarHBondContact O-N 3.29Å; I364-Y367 PolarHBondContact O-N 2.84Å; I364-L368 HydrophobicContact CG2-CD1 3.78Å; I364-L368 HydrophobicContact CG2-CG 4.49Å; I364-L368 WeakPolarHBondContact O-CB 3.39Å; I364-L368 WeakPolarHBondContact O-CD1 3.33Å; I364-L368 VanDerWaalsContact O-CG 3.27Å; I364-L368 WeakPolarHBondContact O-CG 3.26Å; I364-L368 PolarHBondContact O-N 3.24Å; I364-W442 HydrophobicContact CD1-CH2 3.85Å; I364-W442 HydrophobicContact CD1-CZ2 3.75Å; I364-W442 HydrophobicContact CG1-CH2 4.07Å; I364-W442 HydrophobicContact CG1-CZ2 3.98Å; I364-W442 HydrophobicContact CG2-CH2 4.02Å
365	E	94.3	Very high	91.7	Very high	25 Å²	25	34.4 Å²	34.4	12%	0.117	15%	0.154	C	C	.	.	H	α-helix	trans	-54.6	-46.4	173.6	-86.9	172	-153.1	0	0	112.6	T361 K362 K369 R466	T361-E365 PolarHBondContact O-N 3.11Å; K362-E365 VanDerWaalsContact CD-OE2 3.24Å; K362-E365 WeakPolarHBondContact CD-OE2 3.18Å; K362-E365 IonicContact NZ-OE1 2.74Å; K362-E365 IonicContact NZ-OE2 2.74Å; K362-E365 PolarHBondContact NZ-OE2 3.43Å; E365-K369 WeakPolarHBondContact O-CE 2.94Å; E365-K369 WeakPolarHBondContact O-CG 3.13Å; E365-K369 PolarHBondContact O-N 2.85Å; E365-R466 HydrophobicContact CG-CB 3.83Å; E365-R466 HydrophobicContact CG-CG 4.25Å; E365-R466 IonicContact OE1-CZ 3.47Å; E365-R466 IonicContact OE1-NH1 2.7Å; E365-R466 PolarHBondContact OE1-NH1 2.86Å
366	E	95.4	Very high	92.3	Very high	33 Å²	33	26 Å²	26	15%	0.154	12%	0.122	C	C	.	.	H	α-helix	trans	-73.8	-37.5	-178.3	-160.1	70	-178.4	0	0	112.7	C319 V322 H323 K362 A363 I364 L368 K369 L370	C319-E366 HydrophobicContact CB-CG 4.13Å; C319-E366 PolarHBondContact SG-OE1 3.07Å; C319-E366 VanDerWaalsContact SG-OE1 3.42Å; V322-E366 HydrophobicContact CG2-CB 4.46Å; H323-E366 IonicContact CE1-OE1 3.87Å; K362-E366 PolarHBondContact O-N 3.16Å; A363-E366 PolarHBondContact O-N 2.95Å; I364-E366 VanDerWaalsContact C-N 3.34Å; I364-E366 PolarHBondContact O-N 3.29Å; E366-L368 VanDerWaalsContact C-N 3.32Å; E366-L368 PolarHBondContact O-N 3.05Å; E366-K369 WeakPolarHBondContact O-CB 3.39Å; E366-K369 PolarHBondContact O-N 3.07Å; E366-K369 VanDerWaalsContact O-N 3.13Å; E366-K369 WeakPolarHBondContact OE2-CD 3.09Å; E366-K369 WeakPolarHBondContact OE2-CE 3.31Å; E366-K369 IonicContact OE2-NZ 2.78Å; E366-K369 PolarHBondContact OE2-NZ 3.45Å; E366-L370 WeakPolarHBondContact O-CB 3.41Å; E366-L370 PolarHBondContact O-N 2.95Å
367	Y	95.9	Very high	92.6	Very high	7 Å²	7	24.7 Å²	24.7	3%	0.027	12%	0.115	C	C	.	.	H	α-helix	trans	-65.4	-37.4	177.6	-167.5	-117.5	0	0	0	112.3	V322 Q326 A331 L335 A363 I364 K369 L370 I371 L435 V438	V322-Y367 HydrophobicContact CG1-CD2 3.84Å; V322-Y367 HydrophobicContact CG1-CG 4.43Å; Q326-Y367 PolarHBondContact OE1-OH 3.13Å; A331-Y367 HydrophobicContact CB-CD2 4.26Å; A331-Y367 HydrophobicContact CB-CE2 3.57Å; L335-Y367 HydrophobicContact CD1-CD1 3.17Å; L335-Y367 HydrophobicContact CD1-CD2 3.73Å; L335-Y367 HydrophobicContact CD1-CE1 3.59Å; L335-Y367 HydrophobicContact CD1-CE2 4.1Å; L335-Y367 HydrophobicContact CD1-CG 3.21Å; A363-Y367 WeakPolarHBondContact O-CB 3.28Å; A363-Y367 PolarHBondContact O-N 3.18Å; I364-Y367 PolarHBondContact O-N 2.84Å; Y367-K369 VanDerWaalsContact C-N 3.32Å; Y367-K369 PolarHBondContact O-N 3.02Å; Y367-L370 PolarHBondContact O-N 3.49Å; Y367-I371 HydrophobicContact CD1-CG1 4.21Å; Y367-I371 HydrophobicContact CD2-CD1 4.29Å; Y367-I371 HydrophobicContact CD2-CG1 3.71Å; Y367-I371 HydrophobicContact CE1-CG1 4Å; Y367-I371 HydrophobicContact CE2-CD1 3.8Å; Y367-I371 HydrophobicContact CE2-CG1 3.48Å; Y367-I371 VanDerWaalsContact CE2-CG1 3.48Å; Y367-I371 HydrophobicContact CG-CG1 4.11Å; Y367-I371 WeakPolarHBondContact O-CG1 3.44Å; Y367-I371 PolarHBondContact O-N 2.94Å; Y367-L435 HydrophobicContact CD1-CD2 3.5Å; Y367-L435 VanDerWaalsContact CD1-CD2 3.5Å; Y367-L435 HydrophobicContact CE1-CD2 3.73Å; Y367-V438 HydrophobicContact CE1-CG2 3.97Å
368	L	94.8	Very high	92.7	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-61.7	-38.7	172.1	-73.2	165.4	0	0	0	111.7	I364 E366 G372 L435 F439 S462 L463 F467	I364-L368 HydrophobicContact CG2-CD1 3.78Å; I364-L368 HydrophobicContact CG2-CG 4.49Å; I364-L368 WeakPolarHBondContact O-CB 3.39Å; I364-L368 WeakPolarHBondContact O-CD1 3.33Å; I364-L368 VanDerWaalsContact O-CG 3.27Å; I364-L368 WeakPolarHBondContact O-CG 3.26Å; I364-L368 PolarHBondContact O-N 3.24Å; E366-L368 VanDerWaalsContact C-N 3.32Å; E366-L368 PolarHBondContact O-N 3.05Å; L368-G372 WeakPolarHBondContact O-CA 3.19Å; L368-G372 PolarHBondContact O-N 3.2Å; L368-L435 HydrophobicContact CD2-CD1 4.05Å; L368-L435 HydrophobicContact CD2-CD2 3.87Å; L368-F439 HydrophobicContact CD2-CZ 4.08Å; L368-S462 VanDerWaalsContact CD1-O 3.3Å; L368-S462 WeakPolarHBondContact CD1-O 3.08Å; L368-L463 HydrophobicContact CD2-CD1 4.4Å; L368-F467 HydrophobicContact CB-CB 4.05Å; L368-F467 HydrophobicContact CB-CD1 4.47Å; L368-F467 HydrophobicContact CB-CD2 3.84Å; L368-F467 HydrophobicContact CB-CE2 4.41Å; L368-F467 HydrophobicContact CB-CG 3.88Å; L368-F467 HydrophobicContact CD1-CB 4.07Å; L368-F467 WeakPolarHBondContact O-CE2 3.35Å; L368-F467 VanDerWaalsContact O-CZ 3.23Å; L368-F467 WeakPolarHBondContact O-CZ 3.43Å
369	K	92.5	Very high	92.7	Very high	60 Å²	60	25.6 Å²	25.6	26%	0.261	12%	0.12	S	C	.	.	H	α-helix	trans	-66	-53	171.2	-64.9	172.3	-138.3	159.2	0	111.9	E365 E366 Y367 H373 F467 F478	E365-K369 WeakPolarHBondContact O-CE 2.94Å; E365-K369 WeakPolarHBondContact O-CG 3.13Å; E365-K369 PolarHBondContact O-N 2.85Å; E366-K369 WeakPolarHBondContact O-CB 3.39Å; E366-K369 PolarHBondContact O-N 3.07Å; E366-K369 VanDerWaalsContact O-N 3.13Å; E366-K369 WeakPolarHBondContact OE2-CD 3.09Å; E366-K369 WeakPolarHBondContact OE2-CE 3.31Å; E366-K369 IonicContact OE2-NZ 2.78Å; E366-K369 PolarHBondContact OE2-NZ 3.45Å; Y367-K369 VanDerWaalsContact C-N 3.32Å; Y367-K369 PolarHBondContact O-N 3.02Å; K369-H373 VanDerWaalsContact O-CB 3.22Å; K369-H373 WeakPolarHBondContact O-CB 3.49Å; K369-H373 PolarHBondContact O-N 3.16Å; K369-H373 VanDerWaalsContact O-N 3.08Å; K369-F467 HydrophobicContact CG-CE2 4.42Å; K369-F478 HydrophobicContact CG-CE1 4.28Å
370	L	91.4	Very high	92.7	Very high	34 Å²	34	25.5 Å²	25.5	18%	0.178	12%	0.12	C	C	.	.	H	α-helix	trans	-58.7	-51.3	-173.7	177.6	57.3	0	0	0	112.4	V322 Q326 E366 Y367 F549 I553	V322-L370 HydrophobicContact CG1-CD2 3.93Å; Q326-L370 HydrophobicContact CB-CD2 4.2Å; Q326-L370 HydrophobicContact CG-CD2 4.25Å; E366-L370 WeakPolarHBondContact O-CB 3.41Å; E366-L370 PolarHBondContact O-N 2.95Å; Y367-L370 PolarHBondContact O-N 3.49Å; L370-F549 HydrophobicContact CD1-CE2 3.84Å; L370-F549 HydrophobicContact CD1-CZ 3.7Å; L370-F549 HydrophobicContact CG-CE2 4.05Å; L370-F549 HydrophobicContact CG-CZ 4.2Å; L370-I553 HydrophobicContact CD2-CD1 4.16Å
371	I	91.2	Very high	92.7	Very high	12 Å²	12	25.7 Å²	25.7	6%	0.062	12%	0.122	C	C	.	.	H	α-helix	trans	-86.1	-40.6	-178.9	-49.4	-57.1	0	0	0	111.1	Q326 Y367 P432 E434 L435 F549	Q326-I371 HydrophobicContact CG-CD1 4.3Å; Y367-I371 HydrophobicContact CD1-CG1 4.21Å; Y367-I371 HydrophobicContact CD2-CD1 4.29Å; Y367-I371 HydrophobicContact CD2-CG1 3.71Å; Y367-I371 HydrophobicContact CE1-CG1 4Å; Y367-I371 HydrophobicContact CE2-CD1 3.8Å; Y367-I371 HydrophobicContact CE2-CG1 3.48Å; Y367-I371 VanDerWaalsContact CE2-CG1 3.48Å; Y367-I371 HydrophobicContact CG-CG1 4.11Å; Y367-I371 WeakPolarHBondContact O-CG1 3.44Å; Y367-I371 PolarHBondContact O-N 2.94Å; I371-P432 HydrophobicContact CG2-CB 3.62Å; I371-P432 HydrophobicContact CG2-CG 4.3Å; I371-E434 HydrophobicContact CG2-CB 4.3Å; I371-L435 HydrophobicContact CB-CD1 4.45Å; I371-L435 HydrophobicContact CB-CD2 4.28Å; I371-L435 HydrophobicContact CB-CG 4.13Å; I371-L435 HydrophobicContact CG2-CD1 4.43Å; I371-L435 HydrophobicContact CG2-CG 4Å; I371-F549 HydrophobicContact CD1-CB 4.23Å; I371-F549 HydrophobicContact CD1-CD2 3.44Å; I371-F549 VanDerWaalsContact CD1-CD2 3.44Å; I371-F549 HydrophobicContact CD1-CE2 3.95Å; I371-F549 HydrophobicContact CD1-CG 3.92Å
372	G	91.2	Very high	92.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-82.8	-12.6	-169.4	0	0	0	0	0	115.9	L368 K374 Y375 L376	L368-G372 WeakPolarHBondContact O-CA 3.19Å; L368-G372 PolarHBondContact O-N 3.2Å; G372-K374 VanDerWaalsContact C-N 3.28Å; G372-K374 PolarHBondContact O-N 3.1Å; G372-Y375 PolarHBondContact O-N 3.27Å; G372-Y375 VanDerWaalsContact O-N 3.15Å; G372-L376 WeakPolarHBondContact O-CB 3.43Å; G372-L376 PolarHBondContact O-N 2.78Å
373	H	88.3	Confident	92.6	Very high	66 Å²	66	31.4 Å²	31.4	31%	0.306	15%	0.149	S	C	.	.	H	α-helix	trans	-57.2	-36.8	-175	176.3	65.1	0	0	0	113.8	K369 K377 F478	K369-H373 VanDerWaalsContact O-CB 3.22Å; K369-H373 WeakPolarHBondContact O-CB 3.49Å; K369-H373 PolarHBondContact O-N 3.16Å; K369-H373 VanDerWaalsContact O-N 3.08Å; H373-K377 WeakPolarHBondContact O-CB 3.46Å; H373-K377 PolarHBondContact O-N 3.03Å; H373-F478 PolarHBondContact CE1-O 3.2Å; H373-F478 PolarHBondContact ND1-O 2.89Å
374	K	86.6	Confident	92.5	Very high	116 Å²	116	31.4 Å²	31.4	50%	0.504	15%	0.149	S	C	.	.	H	α-helix	trans	-62.9	-55.5	174.2	-177.2	-178.9	177.3	-173.8	0	111	G372 L376 K377 D378 E550	G372-K374 VanDerWaalsContact C-N 3.28Å; G372-K374 PolarHBondContact O-N 3.1Å; K374-L376 VanDerWaalsContact C-N 3.32Å; K374-L376 PolarHBondContact O-N 3.38Å; K374-K377 WeakPolarHBondContact O-CB 3.46Å; K374-K377 PolarHBondContact O-N 2.84Å; K374-K377 VanDerWaalsContact O-N 3.11Å; K374-D378 VanDerWaalsContact O-CG 3.32Å; K374-D378 PolarHBondContact O-N 3.16Å; K374-E550 IonicContact NZ-OE2 2.79Å; K374-E550 PolarHBondContact NZ-OE2 3.45Å
375	Y	91.8	Very high	92.3	Very high	5 Å²	5	35.4 Å²	35.4	2%	0.02	16%	0.163	C	C	.	.	H	α-helix	trans	-55	-43.6	176.6	159	-96.1	0	0	0	112.9	G372 K377 D378 A379 S427 V430 F431 P432 F467 L468	G372-Y375 PolarHBondContact O-N 3.27Å; G372-Y375 VanDerWaalsContact O-N 3.15Å; Y375-K377 VanDerWaalsContact C-N 3.3Å; Y375-K377 PolarHBondContact O-N 3.45Å; Y375-D378 PolarHBondContact O-N 3.37Å; Y375-A379 HydrophobicContact CE2-CB 4.27Å; Y375-A379 VanDerWaalsContact O-CB 3.22Å; Y375-A379 WeakPolarHBondContact O-CB 3.29Å; Y375-A379 PolarHBondContact O-N 2.99Å; Y375-S427 VanDerWaalsContact CE2-OG 3.24Å; Y375-S427 WeakPolarHBondContact CE2-OG 3.32Å; Y375-S427 PolarHBondContact OH-OG 3.39Å; Y375-S427 VanDerWaalsContact OH-OG 3.13Å; Y375-V430 HydrophobicContact CD2-CG2 4.46Å; Y375-F431 HydrophobicContact CD1-CD2 4.36Å; Y375-F431 HydrophobicContact CD1-CE2 4.43Å; Y375-F431 HydrophobicContact CD2-CD2 4.11Å; Y375-F431 AromaticContact CE1-CD2 3.92Å; Y375-F431 HydrophobicContact CE1-CD2 3.92Å; Y375-F431 AromaticContact CE1-CE2 3.94Å; Y375-F431 HydrophobicContact CE1-CE2 3.94Å; Y375-F431 HydrophobicContact CE2-CB 4.3Å; Y375-F431 AromaticContact CE2-CD2 3.62Å; Y375-F431 HydrophobicContact CE2-CD2 3.62Å; Y375-F431 HydrophobicContact CE2-CE2 4.45Å; Y375-F431 HydrophobicContact CE2-CG 4.43Å; Y375-F431 HydrophobicContact CG-CD2 4.45Å; Y375-F431 AromaticContact CZ-CD2 3.53Å; Y375-F431 AromaticContact CZ-CE2 3.96Å; Y375-P432 HydrophobicContact CG-CG 4.29Å; Y375-F467 HydrophobicContact CD1-CE1 4.46Å; Y375-L468 HydrophobicContact CE1-CD2 4.25Å
376	L	93.4	Very high	92.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58	-43.4	177.3	-178.3	71.6	0	0	0	111.8	G372 K374 I380 F467 L468 A471 F478 L480	G372-L376 WeakPolarHBondContact O-CB 3.43Å; G372-L376 PolarHBondContact O-N 2.78Å; K374-L376 VanDerWaalsContact C-N 3.32Å; K374-L376 PolarHBondContact O-N 3.38Å; L376-I380 HydrophobicContact CD1-CD1 3.7Å; L376-I380 HydrophobicContact CD1-CG1 3.98Å; L376-I380 HydrophobicContact CG-CG1 4.46Å; L376-I380 WeakPolarHBondContact O-CG1 3.28Å; L376-I380 PolarHBondContact O-N 3.1Å; L376-F467 HydrophobicContact CB-CE1 3.95Å; L376-F467 HydrophobicContact CB-CZ 3.69Å; L376-F467 HydrophobicContact CD1-CD1 4.43Å; L376-F467 HydrophobicContact CD1-CE1 3.93Å; L376-F467 HydrophobicContact CD1-CZ 4.1Å; L376-F467 HydrophobicContact CD2-CE1 4.44Å; L376-F467 HydrophobicContact CD2-CE2 4Å; L376-F467 HydrophobicContact CD2-CZ 3.77Å; L376-F467 HydrophobicContact CG-CE1 4.34Å; L376-F467 HydrophobicContact CG-CZ 4.08Å; L376-L468 HydrophobicContact CD1-CD2 3.63Å; L376-A471 HydrophobicContact CD1-CB 3.7Å; L376-A471 HydrophobicContact CD2-CB 3.82Å; L376-A471 HydrophobicContact CG-CB 4.27Å; L376-F478 HydrophobicContact CD2-CB 3.95Å; L376-F478 HydrophobicContact CD2-CD1 3.73Å; L376-F478 HydrophobicContact CD2-CG 4.18Å; L376-L480 HydrophobicContact CD2-CD1 4.1Å; L376-L480 HydrophobicContact CD2-CD2 4.17Å; L376-L480 HydrophobicContact CD2-CG 4.41Å; L376-L480 HydrophobicContact CG-CD1 4.12Å; L376-L480 HydrophobicContact CG-CD2 4.15Å
377	K	89.3	Confident	92.1	Very high	48 Å²	48	36 Å²	36	21%	0.209	18%	0.177	C	C	.	.	H	α-helix	trans	-69.3	-41.8	178.7	-174	165.2	-177.4	151.9	0	112.2	Y104 H373 K374 Y375 G381 L480	Y104-K377 WeakPolarHBondContact OH-CE 3.48Å; Y104-K377 PolarHBondContact OH-NZ 3.27Å; H373-K377 WeakPolarHBondContact O-CB 3.46Å; H373-K377 PolarHBondContact O-N 3.03Å; K374-K377 WeakPolarHBondContact O-CB 3.46Å; K374-K377 PolarHBondContact O-N 2.84Å; K374-K377 VanDerWaalsContact O-N 3.11Å; Y375-K377 VanDerWaalsContact C-N 3.3Å; Y375-K377 PolarHBondContact O-N 3.45Å; K377-G381 WeakPolarHBondContact O-CA 3.4Å; K377-G381 PolarHBondContact O-N 2.84Å; K377-L480 HydrophobicContact CB-CD2 4.05Å; K377-L480 HydrophobicContact CG-CD2 4.44Å
378	D	89.9	Confident	91.8	Very high	96 Å²	96	38.2 Å²	38.2	51%	0.513	19%	0.185	S	C	.	.	H	α-helix	trans	-72.9	-34.2	-179	-63.1	-19.7	0	0	0	111.9	K374 Y375	K374-D378 VanDerWaalsContact O-CG 3.32Å; K374-D378 PolarHBondContact O-N 3.16Å; Y375-D378 PolarHBondContact O-N 3.37Å
379	A	92.9	Very high	91.5	Very high	4 Å²	4	45 Å²	45	3%	0.033	22%	0.217	C	C	.	.	H	α-helix	trans	-77.6	-56.2	178.3	0	0	0	0	0	113.1	Y375	Y375-A379 HydrophobicContact CE2-CB 4.27Å; Y375-A379 VanDerWaalsContact O-CB 3.22Å; Y375-A379 WeakPolarHBondContact O-CB 3.29Å; Y375-A379 PolarHBondContact O-N 2.99Å
380	I	94.6	Very high	91.4	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-116.5	-6.6	-170.8	65.7	168.1	0	0	0	115	L376 E382 F383 I384 I424 I472	L376-I380 HydrophobicContact CD1-CD1 3.7Å; L376-I380 HydrophobicContact CD1-CG1 3.98Å; L376-I380 HydrophobicContact CG-CG1 4.46Å; L376-I380 WeakPolarHBondContact O-CG1 3.28Å; L376-I380 PolarHBondContact O-N 3.1Å; I380-E382 PolarHBondContact O-N 3.1Å; I380-F383 PolarHBondContact O-N 2.94Å; I380-I384 HydrophobicContact CB-CD1 4.38Å; I380-I384 HydrophobicContact CD1-CD1 3.72Å; I380-I384 HydrophobicContact CG1-CD1 3.97Å; I380-I384 WeakPolarHBondContact O-CG1 3.47Å; I380-I384 PolarHBondContact O-N 3.25Å; I380-I424 HydrophobicContact CG2-CD1 4.39Å; I380-I424 HydrophobicContact CG2-CG1 3.85Å; I380-I472 HydrophobicContact CD1-CD1 4.45Å; I380-I472 HydrophobicContact CD1-CG1 3.71Å
381	G	92.3	Very high	91.1	Very high	4 Å²	4	50.8 Å²	50.8	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-68.4	-28.1	-176.4	0	0	0	0	0	115	K377 R385	K377-G381 WeakPolarHBondContact O-CA 3.4Å; K377-G381 PolarHBondContact O-N 2.84Å; G381-R385 PolarHBondContact O-N 2.74Å; G381-R385 PolarHBondContact O-NH1 3.15Å; G381-R385 VanDerWaalsContact O-NH1 3.08Å
382	E	91.9	Very high	90.7	Very high	123 Å²	123	55.2 Å²	55.2	58%	0.575	27%	0.267	S	S	*	.	H	α-helix	trans	-70.4	-46.9	169.2	-69.1	-170.4	142.1	0	0	111.7	I380 R385 A386 K423	I380-E382 PolarHBondContact O-N 3.1Å; E382-R385 PolarHBondContact O-N 3.3Å; E382-A386 PolarHBondContact O-N 3.01Å; E382-K423 IonicContact OE2-NZ 3.38Å; E382-K423 PolarHBondContact OE2-NZ 3.23Å
383	F	94.8	Very high	90.6	Very high	18 Å²	18	57.6 Å²	57.6	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-46.1	-178.3	168.8	-105.2	0	0	0	111.6	I380 R385 A386 L387 C416 L419 A420 I496	I380-F383 PolarHBondContact O-N 2.94Å; F383-R385 VanDerWaalsContact C-N 3.33Å; F383-R385 PolarHBondContact O-N 2.7Å; F383-A386 WeakPolarHBondContact O-CB 3.08Å; F383-A386 PolarHBondContact O-N 3.4Å; F383-L387 HydrophobicContact CD1-CD1 4.24Å; F383-L387 HydrophobicContact CE1-CD1 3.61Å; F383-L387 HydrophobicContact CE2-CD1 4.25Å; F383-L387 HydrophobicContact CE2-CG 4.42Å; F383-L387 HydrophobicContact CZ-CD1 3.63Å; F383-L387 HydrophobicContact CZ-CG 4.27Å; F383-L387 PolarHBondContact O-N 2.73Å; F383-L387 VanDerWaalsContact O-N 3.08Å; F383-C416 VanDerWaalsContact CZ-O 3.29Å; F383-C416 WeakPolarHBondContact CZ-O 3.44Å; F383-L419 HydrophobicContact CD2-CB 4.31Å; F383-L419 HydrophobicContact CE2-CB 3.96Å; F383-A420 HydrophobicContact CD1-CB 4.4Å; F383-A420 HydrophobicContact CE1-CB 3.68Å; F383-A420 HydrophobicContact CE2-CB 4.38Å; F383-A420 HydrophobicContact CZ-CB 3.66Å; F383-I496 HydrophobicContact CE1-CG2 4.5Å; F383-I496 HydrophobicContact CZ-CD1 4.15Å
384	I	94.6	Very high	90.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-41.6	175.1	-73.7	167	0	0	0	111.1	I380 A386 L387 Y388 P475 L480 T481 L493	I380-I384 HydrophobicContact CB-CD1 4.38Å; I380-I384 HydrophobicContact CD1-CD1 3.72Å; I380-I384 HydrophobicContact CG1-CD1 3.97Å; I380-I384 WeakPolarHBondContact O-CG1 3.47Å; I380-I384 PolarHBondContact O-N 3.25Å; I384-A386 VanDerWaalsContact C-N 3.34Å; I384-A386 PolarHBondContact O-N 2.75Å; I384-L387 PolarHBondContact O-N 3.19Å; I384-Y388 HydrophobicContact CG2-CD2 4.13Å; I384-Y388 HydrophobicContact CG2-CE2 3.83Å; I384-Y388 VanDerWaalsContact O-CD2 3.25Å; I384-Y388 WeakPolarHBondContact O-CD2 3.41Å; I384-Y388 PolarHBondContact O-N 3.43Å; I384-P475 HydrophobicContact CD1-CB 4.26Å; I384-P475 HydrophobicContact CD1-CG 4.12Å; I384-P475 HydrophobicContact CG1-CG 4.49Å; I384-P475 HydrophobicContact CG2-CB 3.67Å; I384-P475 HydrophobicContact CG2-CG 3.6Å; I384-L480 HydrophobicContact CD1-CD1 3.71Å; I384-T481 HydrophobicContact CG2-CG2 4.05Å; I384-L493 HydrophobicContact CG1-CD2 4.39Å
385	R	91.3	Very high	91.1	Very high	88 Å²	88	49.7 Å²	49.7	33%	0.332	25%	0.245	S	C	.	.	H	α-helix	trans	-63.4	-39.8	177.1	-173.4	-178.4	-67.6	89.5	-1.4	111.9	G381 E382 F383 L387 Y388 E389	G381-R385 PolarHBondContact O-N 2.74Å; G381-R385 PolarHBondContact O-NH1 3.15Å; G381-R385 VanDerWaalsContact O-NH1 3.08Å; E382-R385 PolarHBondContact O-N 3.3Å; F383-R385 VanDerWaalsContact C-N 3.33Å; F383-R385 PolarHBondContact O-N 2.7Å; R385-L387 VanDerWaalsContact C-N 3.31Å; R385-L387 PolarHBondContact O-N 3.47Å; R385-Y388 PolarHBondContact O-N 2.91Å; R385-Y388 VanDerWaalsContact O-N 3.11Å; R385-E389 PolarHBondContact O-N 3.27Å; R385-E389 VanDerWaalsContact O-N 3.14Å
386	A	92.8	Very high	91.2	Very high	56 Å²	56	49.4 Å²	49.4	46%	0.463	24%	0.244	S	C	.	.	H	α-helix	trans	-60.8	-38.7	174	0	0	0	0	0	112.3	E382 F383 I384 Y388 E389 S390	E382-A386 PolarHBondContact O-N 3.01Å; F383-A386 WeakPolarHBondContact O-CB 3.08Å; F383-A386 PolarHBondContact O-N 3.4Å; I384-A386 VanDerWaalsContact C-N 3.34Å; I384-A386 PolarHBondContact O-N 2.75Å; A386-Y388 VanDerWaalsContact C-N 3.27Å; A386-Y388 PolarHBondContact O-N 3.45Å; A386-E389 CarbonylContact O-C 3.15Å; A386-E389 PolarHBondContact O-N 2.81Å; A386-E389 VanDerWaalsContact O-N 3.14Å; A386-S390 WeakPolarHBondContact O-CB 3.41Å; A386-S390 PolarHBondContact O-N 3.4Å
387	L	92.9	Very high	91	Very high	16 Å²	16	50.5 Å²	50.5	8%	0.084	25%	0.25	C	S	.	.	H	α-helix	trans	-67.9	-20.1	174.9	-68.2	176.7	0	0	0	114.4	F383 I384 R385 T489 T492 L493 I496	F383-L387 HydrophobicContact CD1-CD1 4.24Å; F383-L387 HydrophobicContact CE1-CD1 3.61Å; F383-L387 HydrophobicContact CE2-CD1 4.25Å; F383-L387 HydrophobicContact CE2-CG 4.42Å; F383-L387 HydrophobicContact CZ-CD1 3.63Å; F383-L387 HydrophobicContact CZ-CG 4.27Å; F383-L387 PolarHBondContact O-N 2.73Å; F383-L387 VanDerWaalsContact O-N 3.08Å; I384-L387 PolarHBondContact O-N 3.19Å; R385-L387 VanDerWaalsContact C-N 3.31Å; R385-L387 PolarHBondContact O-N 3.47Å; L387-T489 WeakPolarHBondContact O-CG2 3.08Å; L387-T492 HydrophobicContact CD2-CG2 4.38Å; L387-L493 HydrophobicContact CD1-CD2 3.59Å; L387-I496 HydrophobicContact CD1-CD1 3.63Å; L387-I496 HydrophobicContact CD2-CD1 4.47Å
388	Y	89.3	Confident	91.1	Very high	52 Å²	52	51.8 Å²	51.8	20%	0.204	26%	0.263	C	S	.	.	H	α-helix	trans	-87.2	-19.3	171.6	-84.5	-118.6	0	0	0	113	I384 R385 A386 P475 T481 E483 P485 T489 L493	I384-Y388 HydrophobicContact CG2-CD2 4.13Å; I384-Y388 HydrophobicContact CG2-CE2 3.83Å; I384-Y388 VanDerWaalsContact O-CD2 3.25Å; I384-Y388 WeakPolarHBondContact O-CD2 3.41Å; I384-Y388 PolarHBondContact O-N 3.43Å; R385-Y388 PolarHBondContact O-N 2.91Å; R385-Y388 VanDerWaalsContact O-N 3.11Å; A386-Y388 VanDerWaalsContact C-N 3.27Å; A386-Y388 PolarHBondContact O-N 3.45Å; Y388-P475 HydrophobicContact CE2-CG 4.25Å; Y388-T481 HydrophobicContact CD1-CG2 4.46Å; Y388-T481 HydrophobicContact CD2-CG2 4.29Å; Y388-T481 HydrophobicContact CE1-CG2 4.13Å; Y388-T481 HydrophobicContact CE2-CG2 3.92Å; Y388-T481 PolarHBondContact OH-OG1 3.24Å; Y388-E483 VanDerWaalsContact CE1-O 3.26Å; Y388-E483 WeakPolarHBondContact CE1-O 3.02Å; Y388-E483 PolarHBondContact OH-O 3.37Å; Y388-P485 HydrophobicContact CE1-CB 4.05Å; Y388-P485 HydrophobicContact CE2-CB 4.24Å; Y388-P485 VanDerWaalsContact OH-CD 3.25Å; Y388-P485 WeakPolarHBondContact OH-CD 3.47Å; Y388-T489 HydrophobicContact CD2-CG2 3.76Å; Y388-T489 HydrophobicContact CE2-CG2 4.05Å; Y388-T489 HydrophobicContact CG-CG2 4.21Å; Y388-L493 HydrophobicContact CE2-CD1 4.01Å
389	E	89.6	Confident	91	Very high	146 Å²	146	55.5 Å²	55.5	68%	0.682	28%	0.28	S	S	*	.	H	α-helix	trans	-95.4	-11.8	176.6	-68.7	178.7	-163.7	0	0	112.3	R385 A386	R385-E389 PolarHBondContact O-N 3.27Å; R385-E389 VanDerWaalsContact O-N 3.14Å; A386-E389 CarbonylContact O-C 3.15Å; A386-E389 PolarHBondContact O-N 2.81Å; A386-E389 VanDerWaalsContact O-N 3.14Å
390	S	89	Confident	90.8	Very high	31 Å²	31	61.5 Å²	61.5	22%	0.217	30%	0.302	C	S	.	.			trans	-85.3	145.5	176.7	179.4	0	0	0	0	112.8	A386 E392	A386-S390 WeakPolarHBondContact O-CB 3.41Å; A386-S390 PolarHBondContact O-N 3.4Å; S390-E392 VanDerWaalsContact OG-CB 3.28Å; S390-E392 WeakPolarHBondContact OG-CB 3.32Å; S390-E392 WeakPolarHBondContact OG-CG 3.46Å; S390-E392 PolarHBondContact OG-N 3.25Å; S390-E392 PolarHBondContact OG-OE2 2.84Å
391	E	85.2	Confident	90.6	Very high	185 Å²	185	62.4 Å²	62.4	86%	0.864	31%	0.306	S	S	*	.			trans	-101.9	8.1	169.6	-61.2	-175.7	167.9	0	0	111.9	Q488	E391-Q488 PolarHBondContact O-NE2 3.12Å
392	E	83.4	Confident	90.4	Very high	104 Å²	104	65.9 Å²	65.9	49%	0.486	33%	0.328	S	S	.	.			trans	-67	139.5	-178	-73.1	134	-169.2	0	0	112.6	S390 Q488	S390-E392 VanDerWaalsContact OG-CB 3.28Å; S390-E392 WeakPolarHBondContact OG-CB 3.32Å; S390-E392 WeakPolarHBondContact OG-CG 3.46Å; S390-E392 PolarHBondContact OG-N 3.25Å; S390-E392 PolarHBondContact OG-OE2 2.84Å; E392-Q488 PolarHBondContact O-NE2 3.29Å
393	N	88.3	Confident	90.2	Very high	50 Å²	50	65.5 Å²	65.5	27%	0.267	34%	0.336	S	S	.	.			trans	-106.4	128.7	-179.5	-166.2	-12.1	0	0	0	110.5	E395 H409 N412	N393-E395 VanDerWaalsContact OD1-CB 3.3Å; N393-E395 WeakPolarHBondContact OD1-CB 3.43Å; N393-E395 PolarHBondContact OD1-N 2.69Å; N393-H409 VanDerWaalsContact CG-CE1 3.4Å; N393-H409 PolarHBondContact ND2-CE1 2.94Å; N393-N412 PolarHBondContact O-ND2 3.07Å
394	C	92.1	Very high	90	Very high	1 Å²	1	69.1 Å²	69.1	1%	0.007	36%	0.363	C	S	.	.			trans	-119.1	16.5	-179.9	-63.6	0	0	0	0	112	V396 L413 T492 L495	C394-V396 PolarHBondContact O-N 3.22Å; C394-L413 HydrophobicContact CB-CB 4.03Å; C394-L413 HydrophobicContact CB-CD1 4.22Å; C394-T492 HydrophobicContact CB-CG2 3.84Å; C394-L495 WeakPolarHBondContact O-CD1 3.41Å
395	E	93.8	Very high	89.9	Confident	15 Å²	15	71.3 Å²	71.3	7%	0.07	38%	0.377	C	S	.	.			trans	-68.7	115.4	173.8	-179	60.1	-80.6	0	0	110.3	N393 D397 R400 I401 H409 R491	N393-E395 VanDerWaalsContact OD1-CB 3.3Å; N393-E395 WeakPolarHBondContact OD1-CB 3.43Å; N393-E395 PolarHBondContact OD1-N 2.69Å; E395-D397 WeakPolarHBondContact OE1-CB 3.26Å; E395-D397 PolarHBondContact OE1-N 3.04Å; E395-R400 VanDerWaalsContact CD-CD 3.41Å; E395-R400 HydrophobicContact CG-CB 4.04Å; E395-R400 WeakPolarHBondContact OE2-CD 3.37Å; E395-R400 IonicContact OE2-CZ 2.68Å; E395-R400 IonicContact OE2-NE 2.64Å; E395-R400 IonicContact OE2-NH1 2.65Å; E395-R400 PolarHBondContact OE2-NH1 3.25Å; E395-I401 HydrophobicContact CB-CG2 4.27Å; E395-I401 HydrophobicContact CG-CG2 3.98Å; E395-I401 WeakPolarHBondContact O-CD1 3.27Å; E395-H409 WeakPolarHBondContact O-CB 3.33Å; E395-H409 PolarHBondContact O-ND1 2.83Å; E395-R491 VanDerWaalsContact CD-NE 3.26Å; E395-R491 IonicContact OE1-CZ 3.23Å; E395-R491 VanDerWaalsContact OE1-CZ 3.3Å; E395-R491 IonicContact OE1-NE 3.46Å; E395-R491 PolarHBondContact OE1-NE 3.13Å; E395-R491 IonicContact OE1-NH2 2.72Å; E395-R491 PolarHBondContact OE1-NH2 3.22Å; E395-R491 IonicContact OE2-CZ 2.78Å; E395-R491 IonicContact OE2-NE 3.86Å; E395-R491 PolarHBondContact OE2-NE 3.4Å; E395-R491 IonicContact OE2-NH2 3.93Å; E395-R491 PolarHBondContact OE2-NH2 3.05Å
396	V	93.4	Very high	90	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.368	C	S	.	.			trans	-116.5	6.7	-172.4	-70.9	0	0	0	0	113.5	C394 P398 L406 H409 Q410 L413 L495 Y515 M516 F518	C394-V396 PolarHBondContact O-N 3.22Å; V396-P398 VanDerWaalsContact O-CD 3.28Å; V396-P398 WeakPolarHBondContact O-CD 3.49Å; V396-L406 HydrophobicContact CB-CD1 4.3Å; V396-L406 WeakPolarHBondContact O-CD1 3.36Å; V396-H409 HydrophobicContact CG1-CB 4.22Å; V396-Q410 HydrophobicContact CB-CG 4.34Å; V396-Q410 HydrophobicContact CG1-CB 4.4Å; V396-Q410 HydrophobicContact CG1-CG 3.71Å; V396-L413 HydrophobicContact CG1-CB 4.45Å; V396-L413 HydrophobicContact CG1-CD2 4.16Å; V396-L413 HydrophobicContact CG2-CD2 3.78Å; V396-L495 HydrophobicContact CG2-CD1 4.26Å; V396-L495 HydrophobicContact CG2-CD2 4.45Å; V396-Y515 HydrophobicContact CG2-CD2 4.01Å; V396-Y515 HydrophobicContact CG2-CE2 4.15Å; V396-M516 HydrophobicContact CG2-SD 3.95Å; V396-F518 HydrophobicContact CB-CE1 4.14Å; V396-F518 HydrophobicContact CB-CZ 4.41Å; V396-F518 HydrophobicContact CG1-CE1 4.23Å; V396-F518 HydrophobicContact CG1-CZ 4Å; V396-F518 HydrophobicContact CG2-CE1 4.19Å; V396-F518 HydrophobicContact CG2-CZ 4.49Å
397	D	90.6	Very high	90	Very high	23 Å²	23	69.3 Å²	69.3	12%	0.123	37%	0.369	C	S	.	.			trans	-74.9	112.5	171.8	177.1	-5.6	0	0	0	110.7	E395 M399 R400 I401	E395-D397 WeakPolarHBondContact OE1-CB 3.26Å; E395-D397 PolarHBondContact OE1-N 3.04Å; D397-M399 PolarHBondContact O-N 2.89Å; D397-M399 VanDerWaalsContact O-N 3.07Å; D397-M399 WeakPolarHBondContact OD1-CB 3.46Å; D397-M399 PolarHBondContact OD1-N 2.84Å; D397-R400 HydrophobicContact CB-CB 4.3Å; D397-R400 HydrophobicContact CB-CG 4.04Å; D397-R400 PolarHBondContact O-N 2.81Å; D397-R400 WeakPolarHBondContact OD2-CD 3.47Å; D397-R400 WeakPolarHBondContact OD2-CG 3.47Å; D397-R400 IonicContact OD2-NE 2.84Å; D397-R400 PolarHBondContact OD2-NE 3.41Å; D397-I401 WeakPolarHBondContact O-CG1 3.46Å; D397-I401 PolarHBondContact O-N 2.95Å
398	P	89.5	Confident	90	Very high	74 Å²	74	73.3 Å²	73.3	48%	0.481	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.4	-177.5	-21.2	34.2	0	0	0	114.3	V396 R400 L406	V396-P398 VanDerWaalsContact O-CD 3.28Å; V396-P398 WeakPolarHBondContact O-CD 3.49Å; P398-R400 VanDerWaalsContact C-N 3.3Å; P398-L406 HydrophobicContact CG-CD2 4.12Å
399	M	89.6	Confident	90.3	Very high	175 Å²	175	71.9 Å²	71.9	86%	0.862	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.5	174.4	-59.2	-64.1	-70.2	0	0	112.6	D397	D397-M399 PolarHBondContact O-N 2.89Å; D397-M399 VanDerWaalsContact O-N 3.07Å; D397-M399 WeakPolarHBondContact OD1-CB 3.46Å; D397-M399 PolarHBondContact OD1-N 2.84Å
400	R	88.4	Confident	90.5	Very high	130 Å²	130	67.2 Å²	67.2	49%	0.491	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-24.9	-177.8	-65.1	179.2	-179.7	-142.1	-16.4	114.1	E395 D397 P398	E395-R400 VanDerWaalsContact CD-CD 3.41Å; E395-R400 HydrophobicContact CG-CB 4.04Å; E395-R400 WeakPolarHBondContact OE2-CD 3.37Å; E395-R400 IonicContact OE2-CZ 2.68Å; E395-R400 IonicContact OE2-NE 2.64Å; E395-R400 IonicContact OE2-NH1 2.65Å; E395-R400 PolarHBondContact OE2-NH1 3.25Å; D397-R400 HydrophobicContact CB-CB 4.3Å; D397-R400 HydrophobicContact CB-CG 4.04Å; D397-R400 PolarHBondContact O-N 2.81Å; D397-R400 WeakPolarHBondContact OD2-CD 3.47Å; D397-R400 WeakPolarHBondContact OD2-CG 3.47Å; D397-R400 IonicContact OD2-NE 2.84Å; D397-R400 PolarHBondContact OD2-NE 3.41Å; P398-R400 VanDerWaalsContact C-N 3.3Å
401	I	89.9	Confident	90.8	Very high	20 Å²	20	68.5 Å²	68.5	10%	0.103	38%	0.376	C	S	.	.	S	Bend	trans	-129.5	150.3	-173.7	53.2	147.8	0	0	0	112.6	E395 D397 V405 L406 H409	E395-I401 HydrophobicContact CB-CG2 4.27Å; E395-I401 HydrophobicContact CG-CG2 3.98Å; E395-I401 WeakPolarHBondContact O-CD1 3.27Å; D397-I401 WeakPolarHBondContact O-CG1 3.46Å; D397-I401 PolarHBondContact O-N 2.95Å; I401-V405 HydrophobicContact CB-CG2 4.28Å; I401-V405 HydrophobicContact CD1-CG2 4.35Å; I401-L406 HydrophobicContact CD1-CB 3.8Å; I401-L406 HydrophobicContact CD1-CD1 3.73Å; I401-L406 HydrophobicContact CD1-CG 4.38Å; I401-H409 HydrophobicContact CD1-CB 4.48Å
402	P	88.4	Confident	91.3	Very high	77 Å²	77	61.7 Å²	61.7	50%	0.5	35%	0.346	S	S	.	.			trans	-60.8	142.1	173.4	-22.6	33.5	0	0	0	112.2	S404 V405 L406	P402-S404 PolarHBondContact O-N 3.4Å; P402-V405 HydrophobicContact CB-CG2 4.44Å; P402-V405 WeakPolarHBondContact O-CG2 3.35Å; P402-V405 PolarHBondContact O-N 2.97Å; P402-V405 VanDerWaalsContact O-N 3.12Å; P402-L406 PolarHBondContact O-N 3.46Å
403	P	87.3	Confident	91.9	Very high	114 Å²	114	56.8 Å²	56.8	74%	0.74	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-15.3	-179.4	26.5	-35.4	0	0	0	113.6
404	S	90.5	Very high	92.3	Very high	94 Å²	94	57.3 Å²	57.3	66%	0.657	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-20	176.4	59.3	0	0	0	0	114.7	P402	P402-S404 PolarHBondContact O-N 3.4Å
405	V	93	Very high	92.5	Very high	47 Å²	47	61.3 Å²	61.3	29%	0.285	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-7.6	178.1	-60.2	0	0	0	0	112.9	I401 P402 D408 H409	I401-V405 HydrophobicContact CB-CG2 4.28Å; I401-V405 HydrophobicContact CD1-CG2 4.35Å; P402-V405 HydrophobicContact CB-CG2 4.44Å; P402-V405 WeakPolarHBondContact O-CG2 3.35Å; P402-V405 PolarHBondContact O-N 2.97Å; P402-V405 VanDerWaalsContact O-N 3.12Å; V405-D408 PolarHBondContact O-N 2.92Å; V405-H409 PolarHBondContact O-CD2 2.56Å; V405-H409 PolarHBondContact O-N 2.95Å; V405-H409 VanDerWaalsContact O-N 3.07Å
406	L	92.2	Very high	92.6	Very high	27 Å²	27	60.9 Å²	60.9	14%	0.141	34%	0.339	C	S	.	.	H	α-helix	trans	-55	-44.5	176.8	176.7	64.6	0	0	0	113	V396 P398 I401 P402 D408 H409 Q410	V396-L406 HydrophobicContact CB-CD1 4.3Å; V396-L406 WeakPolarHBondContact O-CD1 3.36Å; P398-L406 HydrophobicContact CG-CD2 4.12Å; I401-L406 HydrophobicContact CD1-CB 3.8Å; I401-L406 HydrophobicContact CD1-CD1 3.73Å; I401-L406 HydrophobicContact CD1-CG 4.38Å; P402-L406 PolarHBondContact O-N 3.46Å; L406-D408 VanDerWaalsContact C-N 3.34Å; L406-D408 PolarHBondContact O-N 2.85Å; L406-H409 PolarHBondContact O-N 2.65Å; L406-Q410 HydrophobicContact CD1-CG 3.95Å; L406-Q410 HydrophobicContact CG-CG 4.31Å; L406-Q410 WeakPolarHBondContact O-CB 3.5Å; L406-Q410 WeakPolarHBondContact O-CG 3.29Å; L406-Q410 PolarHBondContact O-N 2.81Å
407	P	93.4	Very high	92.7	Very high	75 Å²	75	60.9 Å²	60.9	49%	0.487	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-39	178.4	-23.3	35.3	0	0	0	113.2	Q410 A411	P407-Q410 PolarHBondContact O-N 3.47Å; P407-A411 WeakPolarHBondContact O-CB 3.34Å; P407-A411 PolarHBondContact O-N 2.85Å
408	D	93.5	Very high	93	Very high	99 Å²	99	63.3 Å²	63.3	53%	0.529	35%	0.35	S	S	.	.	H	α-helix	trans	-67.4	-44.1	179	-59	-31.5	0	0	0	110.8	V405 L406 Q410 A411 N412	V405-D408 PolarHBondContact O-N 2.92Å; L406-D408 VanDerWaalsContact C-N 3.34Å; L406-D408 PolarHBondContact O-N 2.85Å; D408-Q410 VanDerWaalsContact C-N 3.33Å; D408-Q410 PolarHBondContact O-N 3.45Å; D408-A411 PolarHBondContact O-N 3.32Å; D408-N412 PolarHBondContact O-N 3.04Å; D408-N412 PolarHBondContact O-ND2 2.97Å; D408-N412 PolarHBondContact O-OD1 3.36Å
409	H	94.4	Very high	93.3	Very high	22 Å²	22	64.2 Å²	64.2	10%	0.102	35%	0.35	C	S	.	.	H	α-helix	trans	-65.7	-34.5	175.8	-70.9	-162.8	0	0	0	112.5	N393 E395 V396 I401 V405 L406 L413	N393-H409 VanDerWaalsContact CG-CE1 3.4Å; N393-H409 PolarHBondContact ND2-CE1 2.94Å; E395-H409 WeakPolarHBondContact O-CB 3.33Å; E395-H409 PolarHBondContact O-ND1 2.83Å; V396-H409 HydrophobicContact CG1-CB 4.22Å; I401-H409 HydrophobicContact CD1-CB 4.48Å; V405-H409 PolarHBondContact O-CD2 2.56Å; V405-H409 PolarHBondContact O-N 2.95Å; V405-H409 VanDerWaalsContact O-N 3.07Å; L406-H409 PolarHBondContact O-N 2.65Å; H409-L413 WeakPolarHBondContact O-CB 3.32Å; H409-L413 PolarHBondContact O-N 2.73Å
410	Q	95.3	Very high	93.6	Very high	49 Å²	49	55.9 Å²	55.9	23%	0.229	31%	0.309	C	S	.	.	H	α-helix	trans	-66.1	-42.6	173.6	-75.4	179	-24.1	0	0	111.4	V396 L406 P407 D408 L413 R414 F518	V396-Q410 HydrophobicContact CB-CG 4.34Å; V396-Q410 HydrophobicContact CG1-CB 4.4Å; V396-Q410 HydrophobicContact CG1-CG 3.71Å; L406-Q410 HydrophobicContact CD1-CG 3.95Å; L406-Q410 HydrophobicContact CG-CG 4.31Å; L406-Q410 WeakPolarHBondContact O-CB 3.5Å; L406-Q410 WeakPolarHBondContact O-CG 3.29Å; L406-Q410 PolarHBondContact O-N 2.81Å; P407-Q410 PolarHBondContact O-N 3.47Å; D408-Q410 VanDerWaalsContact C-N 3.33Å; D408-Q410 PolarHBondContact O-N 3.45Å; Q410-L413 PolarHBondContact O-N 2.87Å; Q410-R414 WeakPolarHBondContact O-CB 3.39Å; Q410-R414 PolarHBondContact O-N 2.79Å; Q410-F518 HydrophobicContact CB-CD2 3.91Å; Q410-F518 HydrophobicContact CB-CE2 3.5Å; Q410-F518 VanDerWaalsContact CB-CE2 3.5Å; Q410-F518 HydrophobicContact CB-CZ 3.87Å; Q410-F518 HydrophobicContact CG-CD1 4.07Å; Q410-F518 HydrophobicContact CG-CD2 3.94Å; Q410-F518 HydrophobicContact CG-CE1 3.8Å; Q410-F518 HydrophobicContact CG-CE2 3.65Å; Q410-F518 HydrophobicContact CG-CG 4.15Å; Q410-F518 HydrophobicContact CG-CZ 3.58Å
411	A	95.4	Very high	93.9	Very high	58 Å²	58	49.9 Å²	49.9	48%	0.479	29%	0.287	S	S	.	.	H	α-helix	trans	-63.8	-43.5	173.8	0	0	0	0	0	112	P407 D408 R414 M415	P407-A411 WeakPolarHBondContact O-CB 3.34Å; P407-A411 PolarHBondContact O-N 2.85Å; D408-A411 PolarHBondContact O-N 3.32Å; A411-R414 PolarHBondContact O-N 2.84Å; A411-M415 WeakPolarHBondContact O-CB 3.46Å; A411-M415 PolarHBondContact O-N 2.91Å
412	N	95.1	Very high	94.2	Very high	42 Å²	42	52.2 Å²	52.2	23%	0.225	30%	0.304	C	S	.	.	H	α-helix	trans	-58.1	-48.9	174.6	-67.6	-18	0	0	0	111.6	N393 D408 R414 M415 C416	N393-N412 PolarHBondContact O-ND2 3.07Å; D408-N412 PolarHBondContact O-N 3.04Å; D408-N412 PolarHBondContact O-ND2 2.97Å; D408-N412 PolarHBondContact O-OD1 3.36Å; N412-R414 VanDerWaalsContact C-N 3.34Å; N412-R414 PolarHBondContact O-N 2.86Å; N412-M415 PolarHBondContact O-N 2.81Å; N412-C416 PolarHBondContact O-N 2.88Å; N412-C416 PolarHBondContact O-SG 3.24Å
413	L	96.1	Very high	94.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-41.7	179.5	-178.6	56.2	0	0	0	111.4	C394 V396 H409 Q410 C416 C417 L495 I496 M516 F518	C394-L413 HydrophobicContact CB-CB 4.03Å; C394-L413 HydrophobicContact CB-CD1 4.22Å; V396-L413 HydrophobicContact CG1-CB 4.45Å; V396-L413 HydrophobicContact CG1-CD2 4.16Å; V396-L413 HydrophobicContact CG2-CD2 3.78Å; H409-L413 WeakPolarHBondContact O-CB 3.32Å; H409-L413 PolarHBondContact O-N 2.73Å; Q410-L413 PolarHBondContact O-N 2.87Å; L413-C416 PolarHBondContact O-N 2.84Å; L413-C417 PolarHBondContact O-N 2.87Å; L413-C417 PolarHBondContact O-SG 2.89Å; L413-L495 HydrophobicContact CD1-CB 3.81Å; L413-L495 HydrophobicContact CD2-CB 3.97Å; L413-L495 HydrophobicContact CD2-CD1 4.4Å; L413-I496 HydrophobicContact CD1-CG1 3.88Å; L413-M516 HydrophobicContact CD2-CE 4.21Å; L413-F518 HydrophobicContact CD2-CZ 4.21Å
414	R	96.4	Very high	94.9	Very high	62 Å²	62	46.9 Å²	46.9	23%	0.234	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-49.8	176.3	-179.3	171.7	-178.1	150	0.5	111.3	Q410 A411 N412 C416 C417 E418 M519 E521	Q410-R414 WeakPolarHBondContact O-CB 3.39Å; Q410-R414 PolarHBondContact O-N 2.79Å; A411-R414 PolarHBondContact O-N 2.84Å; N412-R414 VanDerWaalsContact C-N 3.34Å; N412-R414 PolarHBondContact O-N 2.86Å; R414-C416 VanDerWaalsContact C-N 3.31Å; R414-C416 PolarHBondContact O-N 2.9Å; R414-C417 PolarHBondContact O-N 2.79Å; R414-E418 HydrophobicContact CG-CG 4.35Å; R414-E418 VanDerWaalsContact CG-OE1 3.27Å; R414-E418 WeakPolarHBondContact CG-OE1 3.42Å; R414-E418 IonicContact CZ-OE1 2.95Å; R414-E418 IonicContact NE-OE1 2.7Å; R414-E418 PolarHBondContact NE-OE1 2.99Å; R414-E418 IonicContact NH2-OE1 2.66Å; R414-E418 WeakPolarHBondContact O-CG 3.35Å; R414-E418 PolarHBondContact O-N 2.96Å; R414-M519 HydrophobicContact CB-CE 4.33Å; R414-M519 HydrophobicContact CB-SD 4.06Å; R414-M519 HydrophobicContact CG-CE 4.48Å; R414-E521 IonicContact CZ-OE2 3.18Å; R414-E521 IonicContact NH1-OE2 2.71Å; R414-E521 PolarHBondContact NH1-OE2 3.36Å; R414-E521 IonicContact NH2-OE2 2.7Å; R414-E521 PolarHBondContact NH2-OE2 2.96Å
415	M	95.6	Very high	95.1	Very high	85 Å²	85	43.8 Å²	43.8	42%	0.419	24%	0.238	S	C	.	.	H	α-helix	trans	-58.6	-40.9	176.9	-178.2	179.7	65.5	0	0	112	A411 N412 C417 L419	A411-M415 WeakPolarHBondContact O-CB 3.46Å; A411-M415 PolarHBondContact O-N 2.91Å; N412-M415 PolarHBondContact O-N 2.81Å; M415-C417 VanDerWaalsContact C-N 3.33Å; M415-C417 PolarHBondContact O-N 2.58Å; M415-L419 HydrophobicContact CG-CD1 4.1Å; M415-L419 WeakPolarHBondContact O-CB 3.49Å; M415-L419 VanDerWaalsContact O-CG 3.26Å; M415-L419 WeakPolarHBondContact O-CG 3.32Å; M415-L419 PolarHBondContact O-N 2.92Å
416	C	96.1	Very high	95.1	Very high	6 Å²	6	46.4 Å²	46.4	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-37.7	174.5	-66.8	0	0	0	0	112.5	F383 N412 L413 R414 A420 I496	F383-C416 VanDerWaalsContact CZ-O 3.29Å; F383-C416 WeakPolarHBondContact CZ-O 3.44Å; N412-C416 PolarHBondContact O-N 2.88Å; N412-C416 PolarHBondContact O-SG 3.24Å; L413-C416 PolarHBondContact O-N 2.84Å; R414-C416 VanDerWaalsContact C-N 3.31Å; R414-C416 PolarHBondContact O-N 2.9Å; C416-A420 VanDerWaalsContact O-CB 3.28Å; C416-A420 WeakPolarHBondContact O-CB 3.39Å; C416-A420 PolarHBondContact O-N 2.98Å; C416-I496 HydrophobicContact CB-CD1 3.7Å; C416-I496 HydrophobicContact CB-CG1 3.96Å
417	C	96.9	Very high	95.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-74.2	-39.8	179.2	-65.9	0	0	0	0	112.3	L413 R414 M415 A420 L421 V499 M519 F522	L413-C417 PolarHBondContact O-N 2.87Å; L413-C417 PolarHBondContact O-SG 2.89Å; R414-C417 PolarHBondContact O-N 2.79Å; M415-C417 VanDerWaalsContact C-N 3.33Å; M415-C417 PolarHBondContact O-N 2.58Å; C417-A420 PolarHBondContact O-N 3.14Å; C417-L421 WeakPolarHBondContact O-CB 3.19Å; C417-L421 PolarHBondContact O-N 2.78Å; C417-V499 HydrophobicContact CB-CG1 4.09Å; C417-M519 HydrophobicContact CB-CE 3.93Å; C417-F522 HydrophobicContact CB-CE1 3.98Å; C417-F522 HydrophobicContact CB-CZ 4.1Å
418	E	95.9	Very high	95	Very high	73 Å²	73	44.3 Å²	44.3	34%	0.341	24%	0.235	S	C	.	.	H	α-helix	trans	-60.1	-45.4	172	-74.7	168.9	-178.2	0	0	110.8	R414 C422 F522	R414-E418 HydrophobicContact CG-CG 4.35Å; R414-E418 VanDerWaalsContact CG-OE1 3.27Å; R414-E418 WeakPolarHBondContact CG-OE1 3.42Å; R414-E418 IonicContact CZ-OE1 2.95Å; R414-E418 IonicContact NE-OE1 2.7Å; R414-E418 PolarHBondContact NE-OE1 2.99Å; R414-E418 IonicContact NH2-OE1 2.66Å; R414-E418 WeakPolarHBondContact O-CG 3.35Å; R414-E418 PolarHBondContact O-N 2.96Å; E418-C422 WeakPolarHBondContact O-CB 3.22Å; E418-C422 PolarHBondContact O-N 3.2Å; E418-F522 HydrophobicContact CB-CE2 4.33Å; E418-F522 HydrophobicContact CG-CD2 3.74Å; E418-F522 HydrophobicContact CG-CE2 3.39Å; E418-F522 HydrophobicContact CG-CZ 4.33Å
419	L	95.6	Very high	94.6	Very high	93 Å²	93	41.8 Å²	41.8	49%	0.487	22%	0.224	S	C	.	.	H	α-helix	trans	-65.6	-42.4	175	-72.3	171.6	0	0	0	113	F383 M415 K423	F383-L419 HydrophobicContact CD2-CB 4.31Å; F383-L419 HydrophobicContact CE2-CB 3.96Å; M415-L419 HydrophobicContact CG-CD1 4.1Å; M415-L419 WeakPolarHBondContact O-CB 3.49Å; M415-L419 VanDerWaalsContact O-CG 3.26Å; M415-L419 WeakPolarHBondContact O-CG 3.32Å; M415-L419 PolarHBondContact O-N 2.92Å; L419-K423 WeakPolarHBondContact O-CB 3.2Å; L419-K423 PolarHBondContact O-N 2.94Å
420	A	95.8	Very high	94.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-48.1	176.6	0	0	0	0	0	111.5	F383 C416 C417 K423 I424 I496	F383-A420 HydrophobicContact CD1-CB 4.4Å; F383-A420 HydrophobicContact CE1-CB 3.68Å; F383-A420 HydrophobicContact CE2-CB 4.38Å; F383-A420 HydrophobicContact CZ-CB 3.66Å; C416-A420 VanDerWaalsContact O-CB 3.28Å; C416-A420 WeakPolarHBondContact O-CB 3.39Å; C416-A420 PolarHBondContact O-N 2.98Å; C417-A420 PolarHBondContact O-N 3.14Å; A420-K423 PolarHBondContact O-N 3.46Å; A420-I424 VanDerWaalsContact O-CG1 3.31Å; A420-I424 WeakPolarHBondContact O-CG1 3.4Å; A420-I424 PolarHBondContact O-N 3.49Å; A420-I496 HydrophobicContact CB-CG2 3.95Å
421	L	95.8	Very high	94.1	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-64.9	-45.6	178.9	-178.4	65	0	0	0	111.4	C417 K423 I424 V425 L503 F522 E526 M530	C417-L421 WeakPolarHBondContact O-CB 3.19Å; C417-L421 PolarHBondContact O-N 2.78Å; L421-K423 VanDerWaalsContact C-N 3.29Å; L421-K423 PolarHBondContact O-N 3.32Å; L421-I424 PolarHBondContact O-N 2.68Å; L421-V425 HydrophobicContact CD1-CG2 3.66Å; L421-V425 HydrophobicContact CG-CG2 3.99Å; L421-V425 WeakPolarHBondContact O-CG2 3.48Å; L421-V425 PolarHBondContact O-N 2.95Å; L421-L503 HydrophobicContact CD1-CD2 3.55Å; L421-L503 HydrophobicContact CD2-CD2 3.67Å; L421-L503 HydrophobicContact CG-CD2 4.2Å; L421-F522 HydrophobicContact CB-CZ 4.49Å; L421-F522 HydrophobicContact CD2-CE2 4.46Å; L421-F522 HydrophobicContact CD2-CZ 4.03Å; L421-E526 HydrophobicContact CD2-CB 3.58Å; L421-E526 HydrophobicContact CD2-CG 3.51Å; L421-E526 WeakPolarHBondContact CD2-OE2 3.35Å; L421-M530 HydrophobicContact CD1-CE 3.89Å
422	C	95.3	Very high	93.9	Very high	68 Å²	68	39.5 Å²	39.5	46%	0.459	21%	0.209	S	C	.	.	H	α-helix	trans	-56.8	-42.4	176.9	179.3	0	0	0	0	111.7	E418 N426	E418-C422 WeakPolarHBondContact O-CB 3.22Å; E418-C422 PolarHBondContact O-N 3.2Å; C422-N426 WeakPolarHBondContact O-CB 3.16Å; C422-N426 PolarHBondContact O-N 2.74Å; C422-N426 PolarHBondContact O-ND2 3.33Å
423	K	95.4	Very high	93.6	Very high	80 Å²	80	42.9 Å²	42.9	35%	0.348	22%	0.218	S	C	.	.	H	α-helix	trans	-64.7	-39	173.7	-80.8	-72.2	-162.3	164.9	0	112.8	E382 L419 A420 L421 S427	E382-K423 IonicContact OE2-NZ 3.38Å; E382-K423 PolarHBondContact OE2-NZ 3.23Å; L419-K423 WeakPolarHBondContact O-CB 3.2Å; L419-K423 PolarHBondContact O-N 2.94Å; A420-K423 PolarHBondContact O-N 3.46Å; L421-K423 VanDerWaalsContact C-N 3.29Å; L421-K423 PolarHBondContact O-N 3.32Å; K423-S427 WeakPolarHBondContact O-CB 3.17Å
424	I	96.1	Very high	93.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-70.5	-54.5	178.8	-67.8	164.8	0	0	0	111.3	I380 A420 L421 N426 S427 F464 L468 V500 F533	I380-I424 HydrophobicContact CG2-CD1 4.39Å; I380-I424 HydrophobicContact CG2-CG1 3.85Å; A420-I424 VanDerWaalsContact O-CG1 3.31Å; A420-I424 WeakPolarHBondContact O-CG1 3.4Å; A420-I424 PolarHBondContact O-N 3.49Å; L421-I424 PolarHBondContact O-N 2.68Å; I424-N426 PolarHBondContact O-N 2.84Å; I424-S427 WeakPolarHBondContact O-CB 3.42Å; I424-S427 PolarHBondContact O-N 2.89Å; I424-S427 PolarHBondContact O-OG 3.35Å; I424-F464 HydrophobicContact CD1-CE1 4.42Å; I424-F464 HydrophobicContact CG2-CE1 4.2Å; I424-F464 HydrophobicContact CG2-CZ 4.13Å; I424-L468 HydrophobicContact CG2-CD1 4.23Å; I424-V500 HydrophobicContact CD1-CG1 4.33Å; I424-F533 HydrophobicContact CG2-CD1 4.45Å; I424-F533 HydrophobicContact CG2-CE1 3.87Å; I424-F533 HydrophobicContact CG2-CE2 4.24Å; I424-F533 HydrophobicContact CG2-CZ 3.75Å; I424-F533 VanDerWaalsContact O-CE2 3.3Å; I424-F533 WeakPolarHBondContact O-CE2 3.27Å
425	V	94.4	Very high	93.2	Very high	29 Å²	29	41.7 Å²	41.7	18%	0.176	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-42.8	-174.8	173.2	0	0	0	0	111.8	L421 S427 H428 F533	L421-V425 HydrophobicContact CD1-CG2 3.66Å; L421-V425 HydrophobicContact CG-CG2 3.99Å; L421-V425 WeakPolarHBondContact O-CG2 3.48Å; L421-V425 PolarHBondContact O-N 2.95Å; V425-S427 PolarHBondContact O-N 3.32Å; V425-H428 PolarHBondContact O-ND1 3.09Å; V425-F533 HydrophobicContact CG1-CB 4.37Å; V425-F533 HydrophobicContact CG2-CB 4.16Å; V425-F533 HydrophobicContact CG2-CG 4.46Å
426	N	92.6	Very high	93.1	Very high	102 Å²	102	37.7 Å²	37.7	55%	0.545	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-70.2	-11.3	177.9	-72	-70.2	0	0	0	113.9	C422 I424	C422-N426 WeakPolarHBondContact O-CB 3.16Å; C422-N426 PolarHBondContact O-N 2.74Å; C422-N426 PolarHBondContact O-ND2 3.33Å; I424-N426 PolarHBondContact O-N 2.84Å
427	S	93.4	Very high	92.9	Very high	7 Å²	7	39.2 Å²	39.2	5%	0.049	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-84.4	-1.8	-179.2	73.9	0	0	0	0	114.7	Y375 K423 I424 V425 C429 V430 F431	Y375-S427 VanDerWaalsContact CE2-OG 3.24Å; Y375-S427 WeakPolarHBondContact CE2-OG 3.32Å; Y375-S427 PolarHBondContact OH-OG 3.39Å; Y375-S427 VanDerWaalsContact OH-OG 3.13Å; K423-S427 WeakPolarHBondContact O-CB 3.17Å; I424-S427 WeakPolarHBondContact O-CB 3.42Å; I424-S427 PolarHBondContact O-N 2.89Å; I424-S427 PolarHBondContact O-OG 3.35Å; V425-S427 PolarHBondContact O-N 3.32Å; S427-C429 PolarHBondContact O-N 2.85Å; S427-C429 VanDerWaalsContact O-N 3.11Å; S427-V430 CarbonylContact O-C 3.56Å; S427-V430 WeakPolarHBondContact O-CG2 3.25Å; S427-V430 PolarHBondContact O-N 3.37Å; S427-F431 PolarHBondContact O-N 2.88Å
428	H	90.1	Very high	92.8	Very high	51 Å²	51	39.3 Å²	39.3	24%	0.236	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-52.2	-35.8	177.6	66.8	-94.8	0	0	0	113.2	V425 V430 F431 F533 E536 I537	V425-H428 PolarHBondContact O-ND1 3.09Å; H428-V430 VanDerWaalsContact C-N 3.27Å; H428-V430 PolarHBondContact O-N 2.88Å; H428-F431 VanDerWaalsContact O-CB 3.23Å; H428-F431 WeakPolarHBondContact O-CB 3.4Å; H428-F431 PolarHBondContact O-N 2.9Å; H428-F533 HydrophobicContact CB-CD2 4.13Å; H428-F533 HydrophobicContact CB-CE2 4.23Å; H428-E536 HydrophobicContact CB-CB 4.18Å; H428-E536 IonicContact CD2-OE2 3.59Å; H428-E536 IonicContact CE1-OE2 2.95Å; H428-E536 IonicContact CG-OE2 3.38Å; H428-E536 VanDerWaalsContact CG-OE2 3.28Å; H428-E536 IonicContact ND1-OE2 3.06Å; H428-E536 PolarHBondContact ND1-OE2 3.45Å; H428-I537 HydrophobicContact CB-CG2 4.21Å
429	C	85.3	Confident	92.7	Very high	46 Å²	46	36 Å²	36	31%	0.311	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-71.6	-18.2	-177.3	65	0	0	0	0	114.2	S427 N545	S427-C429 PolarHBondContact O-N 2.85Å; S427-C429 VanDerWaalsContact O-N 3.11Å; C429-N545 PolarHBondContact O-N 2.84Å
430	V	87.6	Confident	92.6	Very high	70 Å²	70	32 Å²	32	42%	0.424	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-111.5	10.1	174.4	-62.9	0	0	0	0	112.3	Y375 S427 H428	Y375-V430 HydrophobicContact CD2-CG2 4.46Å; S427-V430 CarbonylContact O-C 3.56Å; S427-V430 WeakPolarHBondContact O-CG2 3.25Å; S427-V430 PolarHBondContact O-N 3.37Å; H428-V430 VanDerWaalsContact C-N 3.27Å; H428-V430 PolarHBondContact O-N 2.88Å
431	F	91.8	Very high	92.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-65.7	137.1	177	-167.7	-96.1	0	0	0	110.8	Y375 S427 H428 R433 L435 K436 F439 L463 I537 A546	Y375-F431 HydrophobicContact CD1-CD2 4.36Å; Y375-F431 HydrophobicContact CD1-CE2 4.43Å; Y375-F431 HydrophobicContact CD2-CD2 4.11Å; Y375-F431 AromaticContact CE1-CD2 3.92Å; Y375-F431 HydrophobicContact CE1-CD2 3.92Å; Y375-F431 AromaticContact CE1-CE2 3.94Å; Y375-F431 HydrophobicContact CE1-CE2 3.94Å; Y375-F431 HydrophobicContact CE2-CB 4.3Å; Y375-F431 AromaticContact CE2-CD2 3.62Å; Y375-F431 HydrophobicContact CE2-CD2 3.62Å; Y375-F431 HydrophobicContact CE2-CE2 4.45Å; Y375-F431 HydrophobicContact CE2-CG 4.43Å; Y375-F431 HydrophobicContact CG-CD2 4.45Å; Y375-F431 AromaticContact CZ-CD2 3.53Å; Y375-F431 AromaticContact CZ-CE2 3.96Å; S427-F431 PolarHBondContact O-N 2.88Å; H428-F431 VanDerWaalsContact O-CB 3.23Å; H428-F431 WeakPolarHBondContact O-CB 3.4Å; H428-F431 PolarHBondContact O-N 2.9Å; F431-R433 PolarHBondContact O-N 3.42Å; F431-L435 HydrophobicContact CD1-CB 4.41Å; F431-L435 HydrophobicContact CE1-CB 3.47Å; F431-L435 VanDerWaalsContact CE1-CB 3.47Å; F431-L435 HydrophobicContact CE1-CD1 4.44Å; F431-L435 HydrophobicContact CZ-CB 3.77Å; F431-L435 HydrophobicContact CZ-CD1 4.03Å; F431-K436 HydrophobicContact CD1-CB 4.11Å; F431-K436 HydrophobicContact CE1-CB 4.37Å; F431-F439 HydrophobicContact CE1-CD2 4.12Å; F431-F439 HydrophobicContact CE1-CE2 4.06Å; F431-F439 HydrophobicContact CZ-CD2 4.09Å; F431-F439 AromaticContact CZ-CE2 3.56Å; F431-F439 HydrophobicContact CZ-CE2 3.56Å; F431-F439 HydrophobicContact CZ-CZ 4.39Å; F431-L463 HydrophobicContact CE2-CD1 4.1Å; F431-L463 HydrophobicContact CE2-CD2 4.15Å; F431-L463 HydrophobicContact CZ-CD1 4.47Å; F431-I537 HydrophobicContact CB-CG2 4.2Å; F431-I537 HydrophobicContact CD1-CB 3.95Å; F431-I537 HydrophobicContact CD1-CG2 4.23Å; F431-I537 HydrophobicContact CD2-CB 4.28Å; F431-I537 HydrophobicContact CD2-CG2 3.85Å; F431-I537 HydrophobicContact CE1-CB 4.06Å; F431-I537 HydrophobicContact CE2-CB 4.42Å; F431-I537 HydrophobicContact CE2-CD1 4.46Å; F431-I537 HydrophobicContact CE2-CG2 4.33Å; F431-I537 HydrophobicContact CG-CB 4.07Å; F431-I537 HydrophobicContact CG-CG2 3.83Å; F431-I537 HydrophobicContact CZ-CB 4.32Å; F431-I537 HydrophobicContact CZ-CD1 4.42Å; F431-A546 WeakPolarHBondContact O-CB 3.03Å
432	P	91.1	Very high	92.4	Very high	10 Å²	10	33 Å²	33	7%	0.065	18%	0.175	C	C	.	.			trans	-63.7	133	-173.1	-24.4	35.6	0	0	0	113.2	I371 Y375 E434 L435 K436	I371-P432 HydrophobicContact CG2-CB 3.62Å; I371-P432 HydrophobicContact CG2-CG 4.3Å; Y375-P432 HydrophobicContact CG-CG 4.29Å; P432-E434 VanDerWaalsContact C-N 3.29Å; P432-E434 PolarHBondContact O-N 3.31Å; P432-L435 HydrophobicContact CB-CB 4.41Å; P432-L435 HydrophobicContact CB-CD1 4.16Å; P432-L435 HydrophobicContact CB-CG 4.22Å; P432-L435 HydrophobicContact CG-CD1 3.95Å; P432-L435 PolarHBondContact O-N 3.03Å; P432-K436 PolarHBondContact O-N 3.36Å
433	R	88.9	Confident	92.3	Very high	113 Å²	113	30.7 Å²	30.7	43%	0.426	16%	0.157	S	C	.	.	H	α-helix	trans	-62.4	-35.2	-173.4	-169.8	177.1	168.9	-66.1	-20.1	112.4	F431 K436 E437	F431-R433 PolarHBondContact O-N 3.42Å; R433-K436 WeakPolarHBondContact O-CB 3.36Å; R433-K436 PolarHBondContact O-N 2.81Å; R433-E437 IonicContact CZ-OE1 3.81Å; R433-E437 IonicContact NH1-OE1 3.4Å; R433-E437 PolarHBondContact NH1-OE1 3.43Å; R433-E437 IonicContact NH2-OE1 3.1Å; R433-E437 PolarHBondContact NH2-OE1 3.5Å; R433-E437 PolarHBondContact O-N 3.06Å
434	E	90.7	Very high	92.1	Very high	36 Å²	36	30.9 Å²	30.9	17%	0.168	17%	0.165	C	C	.	.	H	α-helix	trans	-70.2	-38.2	177.8	-63.6	83.3	170.8	0	0	113	I371 P432 K436 E437 V438 G548 F549	I371-E434 HydrophobicContact CG2-CB 4.3Å; P432-E434 VanDerWaalsContact C-N 3.29Å; P432-E434 PolarHBondContact O-N 3.31Å; E434-K436 VanDerWaalsContact C-N 3.35Å; E434-E437 PolarHBondContact O-N 2.95Å; E434-V438 WeakPolarHBondContact O-CG2 3.5Å; E434-V438 PolarHBondContact O-N 2.75Å; E434-V438 VanDerWaalsContact O-N 3.11Å; E434-G548 WeakPolarHBondContact OE1-CA 3.25Å; E434-F549 PolarHBondContact OE1-N 3.08Å
435	L	93.4	Very high	91.9	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-66.3	-41.6	173.2	-67.7	178.8	0	0	0	110.4	Y367 L368 I371 F431 P432 E437 V438 F439	Y367-L435 HydrophobicContact CD1-CD2 3.5Å; Y367-L435 VanDerWaalsContact CD1-CD2 3.5Å; Y367-L435 HydrophobicContact CE1-CD2 3.73Å; L368-L435 HydrophobicContact CD2-CD1 4.05Å; L368-L435 HydrophobicContact CD2-CD2 3.87Å; I371-L435 HydrophobicContact CB-CD1 4.45Å; I371-L435 HydrophobicContact CB-CD2 4.28Å; I371-L435 HydrophobicContact CB-CG 4.13Å; I371-L435 HydrophobicContact CG2-CD1 4.43Å; I371-L435 HydrophobicContact CG2-CG 4Å; F431-L435 HydrophobicContact CD1-CB 4.41Å; F431-L435 HydrophobicContact CE1-CB 3.47Å; F431-L435 VanDerWaalsContact CE1-CB 3.47Å; F431-L435 HydrophobicContact CE1-CD1 4.44Å; F431-L435 HydrophobicContact CZ-CB 3.77Å; F431-L435 HydrophobicContact CZ-CD1 4.03Å; P432-L435 HydrophobicContact CB-CB 4.41Å; P432-L435 HydrophobicContact CB-CD1 4.16Å; P432-L435 HydrophobicContact CB-CG 4.22Å; P432-L435 HydrophobicContact CG-CD1 3.95Å; P432-L435 PolarHBondContact O-N 3.03Å; L435-E437 VanDerWaalsContact C-N 3.34Å; L435-E437 PolarHBondContact O-N 3.36Å; L435-V438 PolarHBondContact O-N 3.47Å; L435-F439 WeakPolarHBondContact O-CG 3.37Å; L435-F439 PolarHBondContact O-N 2.92Å
436	K	92.9	Very high	91.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-40.8	175.7	-172	154	178	167.2	0	112.4	F431 P432 R433 E434 F439 A440 E536 I537 N539 L540 S542 S544	F431-K436 HydrophobicContact CD1-CB 4.11Å; F431-K436 HydrophobicContact CE1-CB 4.37Å; P432-K436 PolarHBondContact O-N 3.36Å; R433-K436 WeakPolarHBondContact O-CB 3.36Å; R433-K436 PolarHBondContact O-N 2.81Å; E434-K436 VanDerWaalsContact C-N 3.35Å; K436-F439 PolarHBondContact O-N 3.3Å; K436-A440 WeakPolarHBondContact O-CB 3.32Å; K436-A440 PolarHBondContact O-N 2.89Å; K436-E536 WeakPolarHBondContact CE-O 3.33Å; K436-E536 PolarHBondContact NZ-O 3.42Å; K436-I537 WeakPolarHBondContact CA-O 3.2Å; K436-I537 WeakPolarHBondContact CG-O 3.2Å; K436-N539 WeakPolarHBondContact CE-O 3.26Å; K436-L540 HydrophobicContact CG-CD2 4.14Å; K436-S542 WeakPolarHBondContact CE-OG 3.33Å; K436-S542 PolarHBondContact NZ-O 3.09Å; K436-S542 PolarHBondContact NZ-OG 3.17Å; K436-S544 WeakPolarHBondContact CD-OG 3.42Å; K436-S544 WeakPolarHBondContact CE-OG 3.31Å; K436-S544 PolarHBondContact NZ-OG 2.65Å
437	E	91.9	Very high	91.6	Very high	38 Å²	38	29.7 Å²	29.7	18%	0.178	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-35.4	173.5	-84.6	-163.6	-143.9	0	0	113.7	K332 R433 E434 L435 S441 L540	K332-E437 HydrophobicContact CD-CB 4.05Å; K332-E437 WeakPolarHBondContact CD-OE2 3.33Å; K332-E437 WeakPolarHBondContact CE-O 3.12Å; K332-E437 WeakPolarHBondContact CE-OE2 3.46Å; K332-E437 IonicContact NZ-OE2 3.15Å; K332-E437 PolarHBondContact NZ-OE2 3.03Å; R433-E437 IonicContact CZ-OE1 3.81Å; R433-E437 IonicContact NH1-OE1 3.4Å; R433-E437 PolarHBondContact NH1-OE1 3.43Å; R433-E437 IonicContact NH2-OE1 3.1Å; R433-E437 PolarHBondContact NH2-OE1 3.5Å; R433-E437 PolarHBondContact O-N 3.06Å; E434-E437 PolarHBondContact O-N 2.95Å; L435-E437 VanDerWaalsContact C-N 3.34Å; L435-E437 PolarHBondContact O-N 3.36Å; E437-S441 WeakPolarHBondContact O-CB 3.41Å; E437-S441 PolarHBondContact O-N 3.34Å; E437-S441 VanDerWaalsContact O-N 3.12Å; E437-L540 HydrophobicContact CB-CD2 4.42Å; E437-L540 HydrophobicContact CG-CD1 4.31Å; E437-L540 HydrophobicContact CG-CD2 3.57Å
438	V	94.7	Very high	91.5	Very high	3 Å²	3	36 Å²	36	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-69.9	-48.7	173.7	170.3	0	0	0	0	110.8	K332 L335 Y367 E434 L435 A440 S441 W442	K332-V438 HydrophobicContact CB-CG2 4.18Å; K332-V438 HydrophobicContact CG-CG2 3.97Å; L335-V438 HydrophobicContact CB-CG1 4.2Å; Y367-V438 HydrophobicContact CE1-CG2 3.97Å; E434-V438 WeakPolarHBondContact O-CG2 3.5Å; E434-V438 PolarHBondContact O-N 2.75Å; E434-V438 VanDerWaalsContact O-N 3.11Å; L435-V438 PolarHBondContact O-N 3.47Å; V438-A440 PolarHBondContact O-N 2.98Å; V438-S441 CarbonylContact O-C 3.56Å; V438-S441 WeakPolarHBondContact O-CB 3.39Å; V438-S441 PolarHBondContact O-N 2.69Å; V438-S441 VanDerWaalsContact O-N 3.14Å; V438-W442 HydrophobicContact CG1-CD2 4.05Å; V438-W442 VanDerWaalsContact CG1-CE2 3.43Å; V438-W442 HydrophobicContact CG1-CH2 4.22Å; V438-W442 HydrophobicContact CG1-CZ2 3.54Å; V438-W442 PolarHBondContact O-N 3.35Å
439	F	94.8	Very high	91.3	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-37.6	-179.5	-64.9	-8.9	0	0	0	112.5	L368 F431 L435 K436 W442 R443 I459 L463 I537	L368-F439 HydrophobicContact CD2-CZ 4.08Å; F431-F439 HydrophobicContact CE1-CD2 4.12Å; F431-F439 HydrophobicContact CE1-CE2 4.06Å; F431-F439 HydrophobicContact CZ-CD2 4.09Å; F431-F439 AromaticContact CZ-CE2 3.56Å; F431-F439 HydrophobicContact CZ-CE2 3.56Å; F431-F439 HydrophobicContact CZ-CZ 4.39Å; L435-F439 WeakPolarHBondContact O-CG 3.37Å; L435-F439 PolarHBondContact O-N 2.92Å; K436-F439 PolarHBondContact O-N 3.3Å; F439-W442 HydrophobicContact CD1-CD2 4.31Å; F439-W442 AromaticContact CD1-CE3 3.5Å; F439-W442 HydrophobicContact CD1-CE3 3.5Å; F439-W442 VanDerWaalsContact CD1-CE3 3.5Å; F439-W442 HydrophobicContact CD1-CH2 4.08Å; F439-W442 AromaticContact CD1-CZ3 3.37Å; F439-W442 HydrophobicContact CD1-CZ3 3.37Å; F439-W442 HydrophobicContact CE1-CE3 4.01Å; F439-W442 AromaticContact CE1-CH2 3.87Å; F439-W442 HydrophobicContact CE1-CH2 3.87Å; F439-W442 AromaticContact CE1-CZ3 3.37Å; F439-W442 HydrophobicContact CE1-CZ3 3.37Å; F439-W442 HydrophobicContact CG-CE3 4.42Å; F439-W442 WeakPolarHBondContact O-CB 3.38Å; F439-W442 PolarHBondContact O-N 3.4Å; F439-R443 PolarHBondContact O-N 3.5Å; F439-I459 HydrophobicContact CB-CD1 4.15Å; F439-I459 HydrophobicContact CB-CG1 4.05Å; F439-I459 HydrophobicContact CB-CG2 4.47Å; F439-I459 HydrophobicContact CD1-CG1 4.44Å; F439-I459 HydrophobicContact CD2-CG2 3.67Å; F439-I459 HydrophobicContact CE2-CG2 3.89Å; F439-I459 HydrophobicContact CG-CG1 4.17Å; F439-I459 HydrophobicContact CG-CG2 4.03Å; F439-I459 HydrophobicContact CZ-CG2 4.43Å; F439-L463 HydrophobicContact CE2-CB 4.38Å; F439-L463 HydrophobicContact CZ-CB 4.29Å; F439-I537 HydrophobicContact CD2-CD1 4.09Å; F439-I537 HydrophobicContact CD2-CG1 4.29Å; F439-I537 HydrophobicContact CE2-CD1 3.99Å
440	A	93.1	Very high	91.3	Very high	10 Å²	10	38.6 Å²	38.6	8%	0.083	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-43.4	171.3	0	0	0	0	0	111.7	K436 V438 W442 R443 V444 S538 L540	K436-A440 WeakPolarHBondContact O-CB 3.32Å; K436-A440 PolarHBondContact O-N 2.89Å; V438-A440 PolarHBondContact O-N 2.98Å; A440-W442 PolarHBondContact O-N 2.64Å; A440-R443 PolarHBondContact O-N 2.75Å; A440-V444 WeakPolarHBondContact O-CG2 3.26Å; A440-V444 PolarHBondContact O-N 3.01Å; A440-S538 VanDerWaalsContact CA-O 3.25Å; A440-S538 WeakPolarHBondContact CA-O 3.49Å; A440-S538 VanDerWaalsContact CB-O 3.31Å; A440-S538 WeakPolarHBondContact CB-O 3.37Å; A440-L540 HydrophobicContact CB-CD1 3.87Å; A440-L540 HydrophobicContact CB-CG 3.8Å
441	S	93.4	Very high	91.1	Very high	24 Å²	24	38 Å²	38	17%	0.168	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-29.6	174.6	-170.2	0	0	0	0	112.7	S336 E437 V438 R445	S336-S441 PolarHBondContact OG-OG 3.16Å; E437-S441 WeakPolarHBondContact O-CB 3.41Å; E437-S441 PolarHBondContact O-N 3.34Å; E437-S441 VanDerWaalsContact O-N 3.12Å; V438-S441 CarbonylContact O-C 3.56Å; V438-S441 WeakPolarHBondContact O-CB 3.39Å; V438-S441 PolarHBondContact O-N 2.69Å; V438-S441 VanDerWaalsContact O-N 3.14Å; S441-R445 WeakPolarHBondContact O-CB 3.31Å; S441-R445 VanDerWaalsContact O-CG 3.25Å; S441-R445 WeakPolarHBondContact O-CG 3.19Å; S441-R445 PolarHBondContact O-N 2.78Å
442	W	93.6	Very high	90.7	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-69.3	-48.3	172.9	-65.1	-14.4	0	0	0	111.3	L335 A339 M340 I364 V438 F439 A440 V444 R445 C446 L458 I459 S462	L335-W442 PolarHBondContact O-NE1 2.8Å; A339-W442 HydrophobicContact CB-CD2 4.4Å; A339-W442 HydrophobicContact CB-CZ2 3.92Å; A339-W442 VanDerWaalsContact CB-NE1 3.28Å; M340-W442 HydrophobicContact CE-CB 4.38Å; M340-W442 HydrophobicContact CE-CG 4.46Å; I364-W442 HydrophobicContact CD1-CH2 3.85Å; I364-W442 HydrophobicContact CD1-CZ2 3.75Å; I364-W442 HydrophobicContact CG1-CH2 4.07Å; I364-W442 HydrophobicContact CG1-CZ2 3.98Å; I364-W442 HydrophobicContact CG2-CH2 4.02Å; V438-W442 HydrophobicContact CG1-CD2 4.05Å; V438-W442 VanDerWaalsContact CG1-CE2 3.43Å; V438-W442 HydrophobicContact CG1-CH2 4.22Å; V438-W442 HydrophobicContact CG1-CZ2 3.54Å; V438-W442 PolarHBondContact O-N 3.35Å; F439-W442 HydrophobicContact CD1-CD2 4.31Å; F439-W442 AromaticContact CD1-CE3 3.5Å; F439-W442 HydrophobicContact CD1-CE3 3.5Å; F439-W442 VanDerWaalsContact CD1-CE3 3.5Å; F439-W442 HydrophobicContact CD1-CH2 4.08Å; F439-W442 AromaticContact CD1-CZ3 3.37Å; F439-W442 HydrophobicContact CD1-CZ3 3.37Å; F439-W442 HydrophobicContact CE1-CE3 4.01Å; F439-W442 AromaticContact CE1-CH2 3.87Å; F439-W442 HydrophobicContact CE1-CH2 3.87Å; F439-W442 AromaticContact CE1-CZ3 3.37Å; F439-W442 HydrophobicContact CE1-CZ3 3.37Å; F439-W442 HydrophobicContact CG-CE3 4.42Å; F439-W442 WeakPolarHBondContact O-CB 3.38Å; F439-W442 PolarHBondContact O-N 3.4Å; A440-W442 PolarHBondContact O-N 2.64Å; W442-V444 PolarHBondContact O-N 2.96Å; W442-R445 PolarHBondContact O-N 3.48Å; W442-C446 WeakPolarHBondContact O-CB 3.48Å; W442-C446 PolarHBondContact O-N 2.83Å; W442-C446 PolarHBondContact O-SG 2.89Å; W442-L458 HydrophobicContact CB-CD2 4.43Å; W442-L458 HydrophobicContact CD2-CD2 3.52Å; W442-L458 HydrophobicContact CE3-CD2 3.15Å; W442-L458 HydrophobicContact CG-CD2 4.11Å; W442-L458 HydrophobicContact CH2-CD2 4.1Å; W442-L458 HydrophobicContact CZ2-CD2 4.42Å; W442-L458 HydrophobicContact CZ3-CD2 3.48Å; W442-L458 VanDerWaalsContact CZ3-CD2 3.48Å; W442-I459 HydrophobicContact CE3-CG1 3.96Å; W442-S462 WeakPolarHBondContact CZ3-OG 3.35Å
443	R	92.8	Very high	90.1	Very high	19 Å²	19	46.5 Å²	46.5	7%	0.072	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-45.8	178.2	-171.4	175.6	-65	102.7	0.6	112.1	F439 A440 R445 C446 A447 E452 A455 D456 S538	F439-R443 PolarHBondContact O-N 3.5Å; A440-R443 PolarHBondContact O-N 2.75Å; R443-R445 PolarHBondContact O-N 3.4Å; R443-C446 PolarHBondContact O-N 2.99Å; R443-A447 WeakPolarHBondContact O-CB 3.01Å; R443-A447 PolarHBondContact O-N 3.26Å; R443-E452 WeakPolarHBondContact CD-OE1 3.41Å; R443-E452 HydrophobicContact CG-CG 4.09Å; R443-A455 HydrophobicContact CB-CB 3.94Å; R443-A455 HydrophobicContact CG-CB 3.91Å; R443-D456 IonicContact CZ-OD1 3.48Å; R443-D456 IonicContact NE-OD1 3.36Å; R443-D456 PolarHBondContact NE-OD1 2.81Å; R443-D456 IonicContact NH2-OD1 2.68Å; R443-D456 PolarHBondContact NH2-OD1 3.41Å; R443-S538 VanDerWaalsContact CZ-OG 3.24Å; R443-S538 PolarHBondContact NH1-O 2.83Å; R443-S538 PolarHBondContact NH1-OG 2.97Å; R443-S538 PolarHBondContact NH2-OG 2.94Å
444	V	92.2	Very high	90	Very high	84 Å²	84	41.3 Å²	41.3	51%	0.509	22%	0.221	S	C	.	.	H	α-helix	trans	-58.2	-50.3	177.6	174.5	0	0	0	0	111	A440 W442 C446 A447 E448	A440-V444 WeakPolarHBondContact O-CG2 3.26Å; A440-V444 PolarHBondContact O-N 3.01Å; W442-V444 PolarHBondContact O-N 2.96Å; V444-C446 VanDerWaalsContact C-N 3.28Å; V444-C446 PolarHBondContact O-N 2.97Å; V444-A447 PolarHBondContact O-N 3.09Å; V444-A447 VanDerWaalsContact O-N 3.15Å; V444-E448 HydrophobicContact CG1-CG 4.49Å; V444-E448 WeakPolarHBondContact O-CG 3.43Å; V444-E448 PolarHBondContact O-N 2.93Å
445	R	91.4	Very high	89.8	Confident	59 Å²	59	39.6 Å²	39.6	22%	0.223	21%	0.213	C	C	.	.	H	α-helix	trans	-67.9	-23.3	179.9	-69.2	179.3	180	-165.7	-3.1	114.3	S336 D337 M340 S441 W442 R443 E448 R449	S336-R445 PolarHBondContact O-NH1 2.97Å; D337-R445 IonicContact OD1-CZ 2.69Å; D337-R445 IonicContact OD1-NH1 3.2Å; D337-R445 PolarHBondContact OD1-NH1 3.05Å; D337-R445 IonicContact OD1-NH2 3.04Å; D337-R445 PolarHBondContact OD1-NH2 2.83Å; M340-R445 HydrophobicContact CG-CB 3.92Å; M340-R445 HydrophobicContact SD-CB 3.62Å; S441-R445 WeakPolarHBondContact O-CB 3.31Å; S441-R445 VanDerWaalsContact O-CG 3.25Å; S441-R445 WeakPolarHBondContact O-CG 3.19Å; S441-R445 PolarHBondContact O-N 2.78Å; W442-R445 PolarHBondContact O-N 3.48Å; R443-R445 PolarHBondContact O-N 3.4Å; R445-E448 WeakPolarHBondContact CA-OE2 3.49Å; R445-R449 WeakPolarHBondContact O-CD 3.23Å; R445-R449 WeakPolarHBondContact O-CG 3.48Å; R445-R449 PolarHBondContact O-NH1 2.84Å
446	C	91	Very high	89.5	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-77.6	-39.7	169.9	-80.2	0	0	0	0	112.2	W442 R443 V444 R449 G450 R451 A455	W442-C446 WeakPolarHBondContact O-CB 3.48Å; W442-C446 PolarHBondContact O-N 2.83Å; W442-C446 PolarHBondContact O-SG 2.89Å; R443-C446 PolarHBondContact O-N 2.99Å; V444-C446 VanDerWaalsContact C-N 3.28Å; V444-C446 PolarHBondContact O-N 2.97Å; C446-R449 CarbonylContact O-C 3.54Å; C446-R449 WeakPolarHBondContact O-CB 3.32Å; C446-R449 PolarHBondContact O-N 2.88Å; C446-R449 VanDerWaalsContact O-N 3.11Å; C446-G450 PolarHBondContact O-N 3.02Å; C446-R451 WeakPolarHBondContact CB-O 3.42Å; C446-R451 CarbonylContact O-C 3.57Å; C446-R451 PolarHBondContact O-N 2.57Å; C446-A455 HydrophobicContact CB-CB 3.9Å
447	A	90.4	Very high	89.2	Confident	46 Å²	46	46.6 Å²	46.6	38%	0.38	24%	0.242	S	C	.	.	H	α-helix	trans	-66.2	-39	174.9	0	0	0	0	0	111.9	R443 V444 R449 G450 E452	R443-A447 WeakPolarHBondContact O-CB 3.01Å; R443-A447 PolarHBondContact O-N 3.26Å; V444-A447 PolarHBondContact O-N 3.09Å; V444-A447 VanDerWaalsContact O-N 3.15Å; A447-R449 PolarHBondContact O-N 3.12Å; A447-R449 VanDerWaalsContact O-N 3.16Å; A447-G450 PolarHBondContact O-N 2.7Å; A447-E452 HydrophobicContact CB-CB 4.47Å
448	E	90.1	Very high	89.1	Confident	140 Å²	140	45 Å²	45	65%	0.654	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27	169.5	-74	169.9	173.5	0	0	113.2	V444 R445	V444-E448 HydrophobicContact CG1-CG 4.49Å; V444-E448 WeakPolarHBondContact O-CG 3.43Å; V444-E448 PolarHBondContact O-N 2.93Å; R445-E448 WeakPolarHBondContact CA-OE2 3.49Å
449	R	87.1	Confident	89	Confident	86 Å²	86	44.9 Å²	44.9	33%	0.325	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	0.2	175.7	-68.7	165.9	169.8	63.3	4.5	113.5	D344 R445 C446 A447 R451	D344-R449 IonicContact OD1-CZ 3.21Å; D344-R449 IonicContact OD1-NE 3.7Å; D344-R449 PolarHBondContact OD1-NE 2.83Å; D344-R449 IonicContact OD1-NH2 2.83Å; D344-R449 PolarHBondContact OD1-NH2 2.83Å; D344-R449 VanDerWaalsContact OD1-NH2 3.15Å; D344-R449 IonicContact OD2-CZ 2.78Å; D344-R449 IonicContact OD2-NE 3.74Å; D344-R449 IonicContact OD2-NH2 3.79Å; D344-R449 PolarHBondContact OD2-NH2 2.82Å; R445-R449 WeakPolarHBondContact O-CD 3.23Å; R445-R449 WeakPolarHBondContact O-CG 3.48Å; R445-R449 PolarHBondContact O-NH1 2.84Å; C446-R449 CarbonylContact O-C 3.54Å; C446-R449 WeakPolarHBondContact O-CB 3.32Å; C446-R449 PolarHBondContact O-N 2.88Å; C446-R449 VanDerWaalsContact O-N 3.11Å; A447-R449 PolarHBondContact O-N 3.12Å; A447-R449 VanDerWaalsContact O-N 3.16Å; R449-R451 VanDerWaalsContact C-N 3.29Å; R449-R451 PolarHBondContact O-N 2.83Å
450	G	84.9	Confident	88.9	Confident	65 Å²	65	44.9 Å²	44.9	67%	0.67	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.4	24.5	-172.5	0	0	0	0	0	114.2	C446 A447	C446-G450 PolarHBondContact O-N 3.02Å; A447-G450 PolarHBondContact O-N 2.7Å
451	R	82.3	Confident	88.7	Confident	59 Å²	59	45.1 Å²	45.1	22%	0.223	24%	0.238	C	C	.	.			trans	-131.7	46.4	-172.9	-62.9	-71.8	-86.4	-70.2	3.7	112.2	I347 E350 C446 R449 D453 I454	I347-R451 PolarHBondContact O-NH2 2.88Å; E350-R451 IonicContact OE1-CZ 3.11Å; E350-R451 IonicContact OE1-NE 3.2Å; E350-R451 PolarHBondContact OE1-NE 3.22Å; E350-R451 IonicContact OE1-NH2 3.66Å; E350-R451 PolarHBondContact OE1-NH2 3.3Å; C446-R451 WeakPolarHBondContact CB-O 3.42Å; C446-R451 CarbonylContact O-C 3.57Å; C446-R451 PolarHBondContact O-N 2.57Å; R449-R451 VanDerWaalsContact C-N 3.29Å; R449-R451 PolarHBondContact O-N 2.83Å; R451-D453 VanDerWaalsContact C-OD1 3.23Å; R451-D453 VanDerWaalsContact CA-OD1 3.25Å; R451-D453 WeakPolarHBondContact CA-OD1 3.39Å; R451-D453 PolarHBondContact O-N 3.23Å; R451-I454 HydrophobicContact CB-CD1 3.9Å; R451-I454 HydrophobicContact CB-CG1 4.13Å; R451-I454 HydrophobicContact CG-CD1 4.32Å; R451-I454 WeakPolarHBondContact O-CB 3.27Å; R451-I454 PolarHBondContact O-N 2.93Å
452	E	82.9	Confident	88.7	Confident	107 Å²	107	44 Å²	44	50%	0.5	23%	0.23	S	C	.	.	H	α-helix	trans	-57.7	-29.3	176.4	-175.6	169	-148.5	0	0	112.3	R443 A447 I454 A455	R443-E452 WeakPolarHBondContact CD-OE1 3.41Å; R443-E452 HydrophobicContact CG-CG 4.09Å; A447-E452 HydrophobicContact CB-CB 4.47Å; E452-I454 PolarHBondContact O-N 2.77Å; E452-A455 WeakPolarHBondContact O-CB 3.44Å; E452-A455 PolarHBondContact O-N 2.7Å
453	D	80.3	Confident	88.8	Confident	80 Å²	80	43.9 Å²	43.9	43%	0.428	23%	0.23	S	C	.	.	H	α-helix	trans	-62.2	-22.6	173.9	71.9	-63.5	0	0	0	114.1	R451 R457	R451-D453 VanDerWaalsContact C-OD1 3.23Å; R451-D453 VanDerWaalsContact CA-OD1 3.25Å; R451-D453 WeakPolarHBondContact CA-OD1 3.39Å; R451-D453 PolarHBondContact O-N 3.23Å; D453-R457 PolarHBondContact O-NE 2.8Å; D453-R457 IonicContact OD2-CZ 3.79Å; D453-R457 IonicContact OD2-NH2 3.84Å; D453-R457 PolarHBondContact OD2-NH2 3.1Å
454	I	85.3	Confident	88.9	Confident	4 Å²	4	43 Å²	43	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-76.3	-32.4	169.9	-62.9	-178.9	0	0	0	110.6	V343 E350 I353 R451 E452 D456 R457 L458	V343-I454 HydrophobicContact CG1-CD1 4.5Å; V343-I454 HydrophobicContact CG2-CG2 4.43Å; E350-I454 HydrophobicContact CG-CD1 4.29Å; I353-I454 HydrophobicContact CD1-CD1 4.22Å; I353-I454 HydrophobicContact CD1-CG2 4.11Å; R451-I454 HydrophobicContact CB-CD1 3.9Å; R451-I454 HydrophobicContact CB-CG1 4.13Å; R451-I454 HydrophobicContact CG-CD1 4.32Å; R451-I454 WeakPolarHBondContact O-CB 3.27Å; R451-I454 PolarHBondContact O-N 2.93Å; E452-I454 PolarHBondContact O-N 2.77Å; I454-D456 PolarHBondContact O-N 3.31Å; I454-R457 PolarHBondContact O-N 2.72Å; I454-L458 HydrophobicContact CG2-CB 4.4Å; I454-L458 HydrophobicContact CG2-CD1 4.33Å; I454-L458 VanDerWaalsContact O-CB 3.23Å; I454-L458 WeakPolarHBondContact O-CB 3.31Å; I454-L458 PolarHBondContact O-N 3.04Å
455	A	87	Confident	88.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-49.6	-171.4	0	0	0	0	0	112.2	R443 C446 E452 R457 L458 I459	R443-A455 HydrophobicContact CB-CB 3.94Å; R443-A455 HydrophobicContact CG-CB 3.91Å; C446-A455 HydrophobicContact CB-CB 3.9Å; E452-A455 WeakPolarHBondContact O-CB 3.44Å; E452-A455 PolarHBondContact O-N 2.7Å; A455-R457 VanDerWaalsContact C-N 3.3Å; A455-R457 PolarHBondContact O-N 2.95Å; A455-L458 PolarHBondContact O-N 2.71Å; A455-I459 WeakPolarHBondContact O-CB 3.41Å; A455-I459 WeakPolarHBondContact O-CD1 3.49Å; A455-I459 WeakPolarHBondContact O-CG1 3.35Å; A455-I459 PolarHBondContact O-N 3.33Å
456	D	86.3	Confident	89	Confident	35 Å²	35	41.9 Å²	41.9	19%	0.187	22%	0.219	C	C	.	.	H	α-helix	trans	-64.6	-36.9	180	-69.4	-6.7	0	0	0	111.6	R443 I454 S460	R443-D456 IonicContact CZ-OD1 3.48Å; R443-D456 IonicContact NE-OD1 3.36Å; R443-D456 PolarHBondContact NE-OD1 2.81Å; R443-D456 IonicContact NH2-OD1 2.68Å; R443-D456 PolarHBondContact NH2-OD1 3.41Å; I454-D456 PolarHBondContact O-N 3.31Å; D456-S460 WeakPolarHBondContact O-CB 3.42Å; D456-S460 PolarHBondContact O-N 2.94Å
457	R	87.6	Confident	89.2	Confident	114 Å²	114	41.9 Å²	41.9	43%	0.43	22%	0.219	S	C	.	.	H	α-helix	trans	-66.9	-37.3	175.3	-63.9	-174.2	-78.6	154.9	-12	112	E350 D453 I454 A455 G461	E350-R457 VanDerWaalsContact CD-NH2 3.32Å; E350-R457 IonicContact OE1-NH2 2.65Å; E350-R457 IonicContact OE2-CZ 2.69Å; E350-R457 VanDerWaalsContact OE2-CZ 3.23Å; E350-R457 IonicContact OE2-NH1 2.81Å; E350-R457 PolarHBondContact OE2-NH1 2.86Å; E350-R457 IonicContact OE2-NH2 3.47Å; E350-R457 PolarHBondContact OE2-NH2 2.86Å; D453-R457 PolarHBondContact O-NE 2.8Å; D453-R457 IonicContact OD2-CZ 3.79Å; D453-R457 IonicContact OD2-NH2 3.84Å; D453-R457 PolarHBondContact OD2-NH2 3.1Å; I454-R457 PolarHBondContact O-N 2.72Å; A455-R457 VanDerWaalsContact C-N 3.3Å; A455-R457 PolarHBondContact O-N 2.95Å; R457-G461 PolarHBondContact O-N 3.31Å
458	L	89.3	Confident	89.4	Confident	5 Å²	5	39.7 Å²	39.7	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-74.1	-42.7	179.2	-170	159.6	0	0	0	111.4	M340 V343 I353 F354 W442 I454 A455 S462	M340-L458 HydrophobicContact CE-CD1 4.22Å; V343-L458 HydrophobicContact CG2-CD1 3.4Å; I353-L458 HydrophobicContact CG2-CD1 4.42Å; F354-L458 HydrophobicContact CD2-CD2 4.42Å; F354-L458 HydrophobicContact CD2-CG 4.08Å; F354-L458 HydrophobicContact CE2-CD1 4.27Å; F354-L458 HydrophobicContact CE2-CD2 3.48Å; F354-L458 VanDerWaalsContact CE2-CD2 3.48Å; F354-L458 HydrophobicContact CE2-CG 3.51Å; F354-L458 HydrophobicContact CZ-CD1 4.24Å; F354-L458 HydrophobicContact CZ-CD2 3.93Å; F354-L458 HydrophobicContact CZ-CG 3.97Å; W442-L458 HydrophobicContact CB-CD2 4.43Å; W442-L458 HydrophobicContact CD2-CD2 3.52Å; W442-L458 HydrophobicContact CE3-CD2 3.15Å; W442-L458 HydrophobicContact CG-CD2 4.11Å; W442-L458 HydrophobicContact CH2-CD2 4.1Å; W442-L458 HydrophobicContact CZ2-CD2 4.42Å; W442-L458 HydrophobicContact CZ3-CD2 3.48Å; W442-L458 VanDerWaalsContact CZ3-CD2 3.48Å; I454-L458 HydrophobicContact CG2-CB 4.4Å; I454-L458 HydrophobicContact CG2-CD1 4.33Å; I454-L458 VanDerWaalsContact O-CB 3.23Å; I454-L458 WeakPolarHBondContact O-CB 3.31Å; I454-L458 PolarHBondContact O-N 3.04Å; A455-L458 PolarHBondContact O-N 2.71Å; L458-S462 WeakPolarHBondContact O-CB 3.35Å; L458-S462 PolarHBondContact O-N 3.15Å; L458-S462 PolarHBondContact O-OG 3.15Å
459	I	92.8	Very high	89.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.8	-50.2	173.5	-67.1	161.7	0	0	0	109.9	F439 W442 A455 S462 L463 L534 I537	F439-I459 HydrophobicContact CB-CD1 4.15Å; F439-I459 HydrophobicContact CB-CG1 4.05Å; F439-I459 HydrophobicContact CB-CG2 4.47Å; F439-I459 HydrophobicContact CD1-CG1 4.44Å; F439-I459 HydrophobicContact CD2-CG2 3.67Å; F439-I459 HydrophobicContact CE2-CG2 3.89Å; F439-I459 HydrophobicContact CG-CG1 4.17Å; F439-I459 HydrophobicContact CG-CG2 4.03Å; F439-I459 HydrophobicContact CZ-CG2 4.43Å; W442-I459 HydrophobicContact CE3-CG1 3.96Å; A455-I459 WeakPolarHBondContact O-CB 3.41Å; A455-I459 WeakPolarHBondContact O-CD1 3.49Å; A455-I459 WeakPolarHBondContact O-CG1 3.35Å; A455-I459 PolarHBondContact O-N 3.33Å; I459-S462 WeakPolarHBondContact O-CB 3.38Å; I459-S462 PolarHBondContact O-N 3.42Å; I459-S462 VanDerWaalsContact O-N 3.17Å; I459-L463 PolarHBondContact O-N 3.28Å; I459-L534 HydrophobicContact CG2-CD2 4.02Å; I459-I537 HydrophobicContact CG2-CD1 4.15Å
460	S	92.1	Very high	90.1	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-62.3	-47.2	178.4	179.5	0	0	0	0	112.5	D456 S462 L463 F464 A504	D456-S460 WeakPolarHBondContact O-CB 3.42Å; D456-S460 PolarHBondContact O-N 2.94Å; S460-S462 PolarHBondContact O-N 2.82Å; S460-L463 PolarHBondContact O-N 3.43Å; S460-F464 WeakPolarHBondContact O-CB 3.35Å; S460-F464 PolarHBondContact O-N 3Å; S460-A504 WeakPolarHBondContact OG-CB 3.28Å; S460-A504 PolarHBondContact OG-O 3.42Å
461	G	90.9	Very high	90.6	Very high	15 Å²	15	27.7 Å²	27.7	16%	0.155	14%	0.135	C	C	.	.	H	α-helix	trans	-64.3	-17.5	175.6	0	0	0	0	0	114.3	R457	R457-G461 PolarHBondContact O-N 3.31Å
462	S	92.6	Very high	91.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-87.4	-53.7	170.3	-57.7	0	0	0	0	111.4	F354 L368 W442 L458 I459 S460 R466	F354-S462 WeakPolarHBondContact CE2-OG 3.5Å; L368-S462 VanDerWaalsContact CD1-O 3.3Å; L368-S462 WeakPolarHBondContact CD1-O 3.08Å; W442-S462 WeakPolarHBondContact CZ3-OG 3.35Å; L458-S462 WeakPolarHBondContact O-CB 3.35Å; L458-S462 PolarHBondContact O-N 3.15Å; L458-S462 PolarHBondContact O-OG 3.15Å; I459-S462 WeakPolarHBondContact O-CB 3.38Å; I459-S462 PolarHBondContact O-N 3.42Å; I459-S462 VanDerWaalsContact O-N 3.17Å; S460-S462 PolarHBondContact O-N 2.82Å; S462-R466 WeakPolarHBondContact O-CB 3.27Å
463	L	95	Very high	91.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-73.2	-44.9	-172.7	-178.6	63.3	0	0	0	113.2	L368 F431 F439 I459 S460 F467 L468 F533 I537	L368-L463 HydrophobicContact CD2-CD1 4.4Å; F431-L463 HydrophobicContact CE2-CD1 4.1Å; F431-L463 HydrophobicContact CE2-CD2 4.15Å; F431-L463 HydrophobicContact CZ-CD1 4.47Å; F439-L463 HydrophobicContact CE2-CB 4.38Å; F439-L463 HydrophobicContact CZ-CB 4.29Å; I459-L463 PolarHBondContact O-N 3.28Å; S460-L463 PolarHBondContact O-N 3.43Å; L463-F467 HydrophobicContact CD1-CD1 4.04Å; L463-F467 WeakPolarHBondContact O-CB 3.31Å; L463-L468 HydrophobicContact CD1-CD1 4.14Å; L463-L468 HydrophobicContact CD1-CG 4.07Å; L463-L468 HydrophobicContact CD2-CD1 4.15Å; L463-L468 HydrophobicContact CG-CD1 3.81Å; L463-L468 HydrophobicContact CG-CG 4.13Å; L463-L468 PolarHBondContact O-N 3.39Å; L463-F533 HydrophobicContact CD2-CE1 3.89Å; L463-F533 HydrophobicContact CD2-CZ 4.16Å; L463-I537 HydrophobicContact CD2-CD1 3.37Å
464	F	95.2	Very high	92.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.106	C	C	.	.	I	π-helix	trans	-84.9	-60.6	-176	-71.8	-84.3	0	0	0	111.4	I424 S460 R466 L468 C469 P470 V500 A504 M530 F533 L534	I424-F464 HydrophobicContact CD1-CE1 4.42Å; I424-F464 HydrophobicContact CG2-CE1 4.2Å; I424-F464 HydrophobicContact CG2-CZ 4.13Å; S460-F464 WeakPolarHBondContact O-CB 3.35Å; S460-F464 PolarHBondContact O-N 3Å; F464-R466 VanDerWaalsContact C-N 3.31Å; F464-R466 PolarHBondContact O-N 3.49Å; F464-L468 HydrophobicContact CD1-CB 4.26Å; F464-L468 HydrophobicContact CD1-CD1 3.88Å; F464-L468 HydrophobicContact CE1-CD1 3.65Å; F464-L468 HydrophobicContact CZ-CD1 4.08Å; F464-L468 PolarHBondContact O-N 3.47Å; F464-C469 VanDerWaalsContact O-CB 3.26Å; F464-C469 WeakPolarHBondContact O-CB 3.24Å; F464-C469 PolarHBondContact O-N 3.42Å; F464-P470 WeakPolarHBondContact O-CD 3.33Å; F464-V500 HydrophobicContact CD1-CG1 3.71Å; F464-V500 HydrophobicContact CE1-CG1 3.83Å; F464-A504 HydrophobicContact CB-CB 3.68Å; F464-A504 HydrophobicContact CD1-CB 3.9Å; F464-A504 HydrophobicContact CD2-CB 3.55Å; F464-A504 HydrophobicContact CE1-CB 4.44Å; F464-A504 HydrophobicContact CE2-CB 4.14Å; F464-A504 HydrophobicContact CG-CB 3.41Å; F464-A504 VanDerWaalsContact CG-CB 3.41Å; F464-M530 HydrophobicContact CE1-CE 3.93Å; F464-M530 HydrophobicContact CE1-SD 4.4Å; F464-M530 HydrophobicContact CE2-CE 4.23Å; F464-M530 HydrophobicContact CE2-SD 3.62Å; F464-M530 HydrophobicContact CZ-CE 3.61Å; F464-M530 HydrophobicContact CZ-SD 3.53Å; F464-M530 VanDerWaalsContact CZ-SD 3.53Å; F464-F533 HydrophobicContact CE2-CD1 4.39Å; F464-F533 HydrophobicContact CE2-CE1 4.04Å; F464-F533 HydrophobicContact CZ-CD1 4.14Å; F464-F533 AromaticContact CZ-CE1 3.76Å; F464-F533 HydrophobicContact CZ-CE1 3.76Å; F464-L534 HydrophobicContact CE2-CD2 4.06Å
465	L	92.6	Very high	92.6	Very high	89 Å²	89	20.5 Å²	20.5	47%	0.466	11%	0.105	S	C	.	.	I	π-helix	trans	-65	-31.2	-172.2	-179.1	63.3	0	0	0	113.7	P470 Q501	L465-P470 WeakPolarHBondContact O-CD 3.25Å; L465-P470 VanDerWaalsContact O-CG 3.22Å; L465-P470 WeakPolarHBondContact O-CG 3.44Å; L465-Q501 HydrophobicContact CD1-CG 4.5Å
466	R	92.7	Very high	92.5	Very high	30 Å²	30	21.2 Å²	21.2	11%	0.113	11%	0.11	C	C	.	.	I	π-helix	trans	-109.6	-7.1	-174	-65.1	178.6	-179.6	-93.7	6.6	114.6	F354 E365 S462 F464	F354-R466 PolarHBondContact O-NH2 2.97Å; E365-R466 HydrophobicContact CG-CB 3.83Å; E365-R466 HydrophobicContact CG-CG 4.25Å; E365-R466 IonicContact OE1-CZ 3.47Å; E365-R466 IonicContact OE1-NH1 2.7Å; E365-R466 PolarHBondContact OE1-NH1 2.86Å; S462-R466 WeakPolarHBondContact O-CB 3.27Å; F464-R466 VanDerWaalsContact C-N 3.31Å; F464-R466 PolarHBondContact O-N 3.49Å
467	F	95.1	Very high	92.5	Very high	1 Å²	1	24.4 Å²	24.4	0%	0.004	13%	0.126	C	C	.	.	I	π-helix	trans	-135.1	-69.8	-179.4	-174.1	-115.4	0	0	0	114	L368 K369 Y375 L376 L463 A471 F478	L368-F467 HydrophobicContact CB-CB 4.05Å; L368-F467 HydrophobicContact CB-CD1 4.47Å; L368-F467 HydrophobicContact CB-CD2 3.84Å; L368-F467 HydrophobicContact CB-CE2 4.41Å; L368-F467 HydrophobicContact CB-CG 3.88Å; L368-F467 HydrophobicContact CD1-CB 4.07Å; L368-F467 WeakPolarHBondContact O-CE2 3.35Å; L368-F467 VanDerWaalsContact O-CZ 3.23Å; L368-F467 WeakPolarHBondContact O-CZ 3.43Å; K369-F467 HydrophobicContact CG-CE2 4.42Å; Y375-F467 HydrophobicContact CD1-CE1 4.46Å; L376-F467 HydrophobicContact CB-CE1 3.95Å; L376-F467 HydrophobicContact CB-CZ 3.69Å; L376-F467 HydrophobicContact CD1-CD1 4.43Å; L376-F467 HydrophobicContact CD1-CE1 3.93Å; L376-F467 HydrophobicContact CD1-CZ 4.1Å; L376-F467 HydrophobicContact CD2-CE1 4.44Å; L376-F467 HydrophobicContact CD2-CE2 4Å; L376-F467 HydrophobicContact CD2-CZ 3.77Å; L376-F467 HydrophobicContact CG-CE1 4.34Å; L376-F467 HydrophobicContact CG-CZ 4.08Å; L463-F467 HydrophobicContact CD1-CD1 4.04Å; L463-F467 WeakPolarHBondContact O-CB 3.31Å; F467-A471 VanDerWaalsContact O-CB 3.26Å; F467-A471 WeakPolarHBondContact O-CB 3.49Å; F467-A471 PolarHBondContact O-N 3.03Å; F467-F478 HydrophobicContact CD2-CD1 4.45Å; F467-F478 AromaticContact CD2-CE1 3.85Å; F467-F478 HydrophobicContact CD2-CE1 3.85Å; F467-F478 HydrophobicContact CE2-CD1 4.24Å; F467-F478 HydrophobicContact CE2-CE1 4.07Å
468	L	96	Very high	92.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.112	C	C	.	.	I	π-helix	trans	-65	-49.9	-174.4	-65.5	178.8	0	0	0	113.1	Y375 L376 I424 L463 F464 A471 I472	Y375-L468 HydrophobicContact CE1-CD2 4.25Å; L376-L468 HydrophobicContact CD1-CD2 3.63Å; I424-L468 HydrophobicContact CG2-CD1 4.23Å; L463-L468 HydrophobicContact CD1-CD1 4.14Å; L463-L468 HydrophobicContact CD1-CG 4.07Å; L463-L468 HydrophobicContact CD2-CD1 4.15Å; L463-L468 HydrophobicContact CG-CD1 3.81Å; L463-L468 HydrophobicContact CG-CG 4.13Å; L463-L468 PolarHBondContact O-N 3.39Å; F464-L468 HydrophobicContact CD1-CB 4.26Å; F464-L468 HydrophobicContact CD1-CD1 3.88Å; F464-L468 HydrophobicContact CE1-CD1 3.65Å; F464-L468 HydrophobicContact CZ-CD1 4.08Å; F464-L468 PolarHBondContact O-N 3.47Å; L468-A471 PolarHBondContact O-N 3.21Å; L468-I472 WeakPolarHBondContact O-CG1 3.27Å; L468-I472 PolarHBondContact O-N 3.21Å
469	C	96.6	Very high	92.3	Very high	6 Å²	6	25.1 Å²	25.1	4%	0.041	14%	0.137	C	C	.	.	H	α-helix	trans	-66.8	-43.9	-177.7	-62.5	0	0	0	0	112.4	F464 A471 I472 M473 A497 Q501	F464-C469 VanDerWaalsContact O-CB 3.26Å; F464-C469 WeakPolarHBondContact O-CB 3.24Å; F464-C469 PolarHBondContact O-N 3.42Å; C469-A471 VanDerWaalsContact C-N 3.3Å; C469-A471 PolarHBondContact O-N 3.17Å; C469-I472 PolarHBondContact O-N 2.95Å; C469-M473 WeakPolarHBondContact O-CG 3.47Å; C469-M473 PolarHBondContact O-N 2.88Å; C469-A497 HydrophobicContact CB-CB 4.46Å; C469-Q501 PolarHBondContact SG-OE1 3.41Å
470	P	95.6	Very high	92	Very high	33 Å²	33	25.5 Å²	25.5	21%	0.214	14%	0.139	C	C	.	.	H	α-helix	trans	-56.5	-39	169.1	-28.7	37	0	0	0	113.9	F464 L465 M473 S474 F478	F464-P470 WeakPolarHBondContact O-CD 3.33Å; L465-P470 WeakPolarHBondContact O-CD 3.25Å; L465-P470 VanDerWaalsContact O-CG 3.22Å; L465-P470 WeakPolarHBondContact O-CG 3.44Å; P470-M473 PolarHBondContact O-N 2.84Å; P470-S474 PolarHBondContact O-N 3.21Å; P470-F478 HydrophobicContact CB-CE2 3.84Å; P470-F478 HydrophobicContact CB-CZ 3.84Å
471	A	95.4	Very high	91.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.7	-33.5	177.3	0	0	0	0	0	113.5	L376 F467 L468 C469 P475 F478 L480	L376-A471 HydrophobicContact CD1-CB 3.7Å; L376-A471 HydrophobicContact CD2-CB 3.82Å; L376-A471 HydrophobicContact CG-CB 4.27Å; F467-A471 VanDerWaalsContact O-CB 3.26Å; F467-A471 WeakPolarHBondContact O-CB 3.49Å; F467-A471 PolarHBondContact O-N 3.03Å; L468-A471 PolarHBondContact O-N 3.21Å; C469-A471 VanDerWaalsContact C-N 3.3Å; C469-A471 PolarHBondContact O-N 3.17Å; A471-P475 VanDerWaalsContact O-CA 3.23Å; A471-P475 WeakPolarHBondContact O-CA 3.19Å; A471-P475 WeakPolarHBondContact O-CG 3.31Å; A471-F478 VanDerWaalsContact CA-CD2 3.48Å; A471-F478 HydrophobicContact CB-CB 4.11Å; A471-F478 HydrophobicContact CB-CD1 3.84Å; A471-F478 HydrophobicContact CB-CD2 3.81Å; A471-F478 HydrophobicContact CB-CE1 4.18Å; A471-F478 HydrophobicContact CB-CE2 4.15Å; A471-F478 HydrophobicContact CB-CG 3.63Å; A471-F478 HydrophobicContact CB-CZ 4.33Å; A471-L480 HydrophobicContact CB-CD1 4.26Å
472	I	95.9	Very high	91.1	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-67.2	-48.7	170.6	-65.4	164.2	0	0	0	109.8	I380 L468 C469 S474 P475 L493 I496 A497	I380-I472 HydrophobicContact CD1-CD1 4.45Å; I380-I472 HydrophobicContact CD1-CG1 3.71Å; L468-I472 WeakPolarHBondContact O-CG1 3.27Å; L468-I472 PolarHBondContact O-N 3.21Å; C469-I472 PolarHBondContact O-N 2.95Å; I472-S474 VanDerWaalsContact C-N 3.33Å; I472-S474 PolarHBondContact O-N 2.88Å; I472-P475 WeakPolarHBondContact O-CD 3.39Å; I472-P475 WeakPolarHBondContact O-CG 3.48Å; I472-L493 HydrophobicContact CG2-CB 4.46Å; I472-L493 HydrophobicContact CG2-CD2 4.03Å; I472-L493 WeakPolarHBondContact O-CB 3.22Å; I472-L493 WeakPolarHBondContact O-CD2 3.37Å; I472-I496 HydrophobicContact CG2-CG2 4.34Å; I472-A497 HydrophobicContact CB-CB 4.24Å; I472-A497 HydrophobicContact CG2-CB 3.99Å
473	M	93.6	Very high	90.5	Very high	74 Å²	74	31.9 Å²	31.9	37%	0.365	17%	0.167	S	C	.	.	H	α-helix	trans	-67.5	-27.5	-178.5	-66.2	-163.3	-50	0	0	114.3	C469 P470 A497	C469-M473 WeakPolarHBondContact O-CG 3.47Å; C469-M473 PolarHBondContact O-N 2.88Å; P470-M473 PolarHBondContact O-N 2.84Å; M473-A497 HydrophobicContact CG-CB 3.36Å; M473-A497 HydrophobicContact SD-CB 4.21Å
474	S	90.6	Very high	89.9	Confident	24 Å²	24	35.7 Å²	35.7	17%	0.168	18%	0.181	C	C	.	.			trans	-144.3	68.7	-176.3	-64.7	0	0	0	0	112.1	P470 I472 S476 L477	P470-S474 PolarHBondContact O-N 3.21Å; I472-S474 VanDerWaalsContact C-N 3.33Å; I472-S474 PolarHBondContact O-N 2.88Å; S474-S476 PolarHBondContact O-N 2.88Å; S474-S476 VanDerWaalsContact O-N 3.13Å; S474-L477 PolarHBondContact O-N 3.42Å
475	P	91.7	Very high	89.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-63.4	-25.7	-169.6	-22	33.5	0	0	0	114.8	I384 Y388 A471 I472 F478 N479 L480 T481 L493	I384-P475 HydrophobicContact CD1-CB 4.26Å; I384-P475 HydrophobicContact CD1-CG 4.12Å; I384-P475 HydrophobicContact CG1-CG 4.49Å; I384-P475 HydrophobicContact CG2-CB 3.67Å; I384-P475 HydrophobicContact CG2-CG 3.6Å; Y388-P475 HydrophobicContact CE2-CG 4.25Å; A471-P475 VanDerWaalsContact O-CA 3.23Å; A471-P475 WeakPolarHBondContact O-CA 3.19Å; A471-P475 WeakPolarHBondContact O-CG 3.31Å; I472-P475 WeakPolarHBondContact O-CD 3.39Å; I472-P475 WeakPolarHBondContact O-CG 3.48Å; P475-F478 CarbonylContact O-C 3.49Å; P475-F478 PolarHBondContact O-N 3.42Å; P475-N479 PolarHBondContact O-N 3.33Å; P475-L480 HydrophobicContact CB-CB 3.97Å; P475-L480 HydrophobicContact CB-CD1 4.25Å; P475-L480 WeakPolarHBondContact O-CB 3.24Å; P475-L480 PolarHBondContact O-N 2.89Å; P475-T481 HydrophobicContact CB-CG2 4.46Å; P475-L493 HydrophobicContact CG-CD1 4Å
476	S	85.9	Confident	89.1	Confident	15 Å²	15	36.3 Å²	36.3	11%	0.105	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-70.5	-28.7	176.8	53.2	0	0	0	0	113.4	S474 F478 N479 T481	S474-S476 PolarHBondContact O-N 2.88Å; S474-S476 VanDerWaalsContact O-N 3.13Å; S476-F478 PolarHBondContact O-N 3.39Å; S476-N479 PolarHBondContact O-N 3.24Å; S476-T481 WeakPolarHBondContact CA-O 3.32Å
477	L	86	Confident	88.8	Confident	103 Å²	103	43.2 Å²	43.2	54%	0.539	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-72.3	-18.4	172.7	-60.7	-178.5	0	0	0	112.5	S474	S474-L477 PolarHBondContact O-N 3.42Å
478	F	88.3	Confident	88.6	Confident	29 Å²	29	46.5 Å²	46.5	13%	0.127	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-105.1	13.5	176.9	-72.8	-98.6	0	0	0	112.7	K369 H373 L376 F467 P470 A471 P475 S476 L480	K369-F478 HydrophobicContact CG-CE1 4.28Å; H373-F478 PolarHBondContact CE1-O 3.2Å; H373-F478 PolarHBondContact ND1-O 2.89Å; L376-F478 HydrophobicContact CD2-CB 3.95Å; L376-F478 HydrophobicContact CD2-CD1 3.73Å; L376-F478 HydrophobicContact CD2-CG 4.18Å; F467-F478 HydrophobicContact CD2-CD1 4.45Å; F467-F478 AromaticContact CD2-CE1 3.85Å; F467-F478 HydrophobicContact CD2-CE1 3.85Å; F467-F478 HydrophobicContact CE2-CD1 4.24Å; F467-F478 HydrophobicContact CE2-CE1 4.07Å; P470-F478 HydrophobicContact CB-CE2 3.84Å; P470-F478 HydrophobicContact CB-CZ 3.84Å; A471-F478 VanDerWaalsContact CA-CD2 3.48Å; A471-F478 HydrophobicContact CB-CB 4.11Å; A471-F478 HydrophobicContact CB-CD1 3.84Å; A471-F478 HydrophobicContact CB-CD2 3.81Å; A471-F478 HydrophobicContact CB-CE1 4.18Å; A471-F478 HydrophobicContact CB-CE2 4.15Å; A471-F478 HydrophobicContact CB-CG 3.63Å; A471-F478 HydrophobicContact CB-CZ 4.33Å; P475-F478 CarbonylContact O-C 3.49Å; P475-F478 PolarHBondContact O-N 3.42Å; S476-F478 PolarHBondContact O-N 3.39Å; F478-L480 HydrophobicContact CB-CD1 4.25Å; F478-L480 HydrophobicContact CB-CG 4.11Å; F478-L480 PolarHBondContact O-N 2.76Å
479	N	84.6	Confident	88.4	Confident	104 Å²	104	47.2 Å²	47.2	56%	0.556	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	28.5	179.9	-57.5	-42	0	0	0	114.6	P475 S476	P475-N479 PolarHBondContact O-N 3.33Å; S476-N479 PolarHBondContact O-N 3.24Å
480	L	86.1	Confident	88.2	Confident	8 Å²	8	48.4 Å²	48.4	4%	0.042	25%	0.247	C	C	.	.	S	Bend	trans	-84	-32.4	176.2	-56.4	176	0	0	0	111.4	L376 K377 I384 A471 P475 F478	L376-L480 HydrophobicContact CD2-CD1 4.1Å; L376-L480 HydrophobicContact CD2-CD2 4.17Å; L376-L480 HydrophobicContact CD2-CG 4.41Å; L376-L480 HydrophobicContact CG-CD1 4.12Å; L376-L480 HydrophobicContact CG-CD2 4.15Å; K377-L480 HydrophobicContact CB-CD2 4.05Å; K377-L480 HydrophobicContact CG-CD2 4.44Å; I384-L480 HydrophobicContact CD1-CD1 3.71Å; A471-L480 HydrophobicContact CB-CD1 4.26Å; P475-L480 HydrophobicContact CB-CB 3.97Å; P475-L480 HydrophobicContact CB-CD1 4.25Å; P475-L480 WeakPolarHBondContact O-CB 3.24Å; P475-L480 PolarHBondContact O-N 2.89Å; F478-L480 HydrophobicContact CB-CD1 4.25Å; F478-L480 HydrophobicContact CB-CG 4.11Å; F478-L480 PolarHBondContact O-N 2.76Å
481	T	83.3	Confident	88.1	Confident	25 Å²	25	49 Å²	49	15%	0.153	25%	0.245	C	C	.	.			trans	-132.6	151.2	172.2	57.8	0	0	0	0	110.2	I384 Y388 P475 S476 E483	I384-T481 HydrophobicContact CG2-CG2 4.05Å; Y388-T481 HydrophobicContact CD1-CG2 4.46Å; Y388-T481 HydrophobicContact CD2-CG2 4.29Å; Y388-T481 HydrophobicContact CE1-CG2 4.13Å; Y388-T481 HydrophobicContact CE2-CG2 3.92Å; Y388-T481 PolarHBondContact OH-OG1 3.24Å; P475-T481 HydrophobicContact CB-CG2 4.46Å; S476-T481 WeakPolarHBondContact CA-O 3.32Å; T481-E483 PolarHBondContact OG1-O 3.11Å
482	Q	80.1	Confident	88.1	Confident	55 Å²	55	49.4 Å²	49.4	26%	0.257	25%	0.248	S	C	.	.	S	Bend	trans	-79.8	-40.9	167.3	177.8	-178.4	-17.9	0	0	110.9	H96 R179 E193	H96-Q482 PolarHBondContact CE1-OE1 2.65Å; R179-Q482 PolarHBondContact O-NE2 2.77Å; E193-Q482 PolarHBondContact OE2-NE2 2.78Å
483	E	79.4	Confident	88.1	Confident	73 Å²	73	49.4 Å²	49.4	34%	0.341	25%	0.247	S	C	.	.	S	Bend	trans	-77.9	134.1	-172.8	-162.7	160.1	169.7	0	0	111	T181 K183 Y388 T481	T181-E483 HydrophobicContact CG2-CB 4.05Å; T181-E483 HydrophobicContact CG2-CG 3.98Å; K183-E483 VanDerWaalsContact CE-OE1 3.25Å; K183-E483 WeakPolarHBondContact CE-OE1 3.41Å; K183-E483 VanDerWaalsContact NZ-CG 3.25Å; K183-E483 IonicContact NZ-OE1 3.82Å; K183-E483 PolarHBondContact NZ-OE1 3.45Å; Y388-E483 VanDerWaalsContact CE1-O 3.26Å; Y388-E483 WeakPolarHBondContact CE1-O 3.02Å; Y388-E483 PolarHBondContact OH-O 3.37Å; T481-E483 PolarHBondContact OG1-O 3.11Å
484	Y	82.3	Confident	88.2	Confident	80 Å²	80	47.7 Å²	47.7	31%	0.314	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-67.5	134.2	168.1	-159.7	-88.2	0	0	0	109	F190 W191	F190-Y484 AromaticContact CE1-CD1 3.98Å; F190-Y484 HydrophobicContact CE1-CD1 3.98Å; F190-Y484 HydrophobicContact CE1-CG 4.12Å; W191-Y484 WeakPolarHBondContact O-CB 3.42Å
485	P	86.5	Confident	88.5	Confident	8 Å²	8	46.6 Å²	46.6	5%	0.052	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-62.6	150.2	-177.8	26.8	-32	0	0	0	110.5	Y388 T489 L493	Y388-P485 HydrophobicContact CE1-CB 4.05Å; Y388-P485 HydrophobicContact CE2-CB 4.24Å; Y388-P485 VanDerWaalsContact OH-CD 3.25Å; Y388-P485 WeakPolarHBondContact OH-CD 3.47Å; P485-T489 HydrophobicContact CB-CG2 3.95Å; P485-L493 HydrophobicContact CB-CD1 4.29Å; P485-L493 HydrophobicContact CG-CD1 4.49Å
486	D	84.9	Confident	88.8	Confident	93 Å²	93	46.6 Å²	46.6	50%	0.497	23%	0.233	S	C	.	.			trans	-74.7	177.5	170.9	75.7	1.7	0	0	0	111.7	Q488 T489 S490	D486-Q488 VanDerWaalsContact C-N 3.29Å; D486-Q488 PolarHBondContact O-N 2.8Å; D486-Q488 PolarHBondContact OD1-N 2.78Å; D486-T489 PolarHBondContact O-N 3.33Å; D486-T489 VanDerWaalsContact OD1-CB 3.31Å; D486-T489 WeakPolarHBondContact OD1-CB 3.04Å; D486-T489 PolarHBondContact OD1-N 2.83Å; D486-T489 PolarHBondContact OD1-OG1 3.21Å; D486-S490 WeakPolarHBondContact O-CB 3.24Å; D486-S490 PolarHBondContact O-N 2.67Å
487	E	86.5	Confident	89.3	Confident	175 Å²	175	46 Å²	46	82%	0.818	23%	0.23	S	C	*	.	H	α-helix	trans	-61.6	-36.6	-174.5	-168.9	173.4	178.2	0	0	112.7	R491	E487-R491 VanDerWaalsContact O-CB 3.26Å; E487-R491 WeakPolarHBondContact O-CB 3.45Å; E487-R491 PolarHBondContact O-N 2.91Å
488	Q	90.3	Very high	89.8	Confident	71 Å²	71	43.1 Å²	43.1	33%	0.332	21%	0.213	S	C	.	.	H	α-helix	trans	-72.9	-48.7	178.8	179.3	173.4	-31.5	0	0	111.6	E391 E392 D486 S490 R491 T492	E391-Q488 PolarHBondContact O-NE2 3.12Å; E392-Q488 PolarHBondContact O-NE2 3.29Å; D486-Q488 VanDerWaalsContact C-N 3.29Å; D486-Q488 PolarHBondContact O-N 2.8Å; D486-Q488 PolarHBondContact OD1-N 2.78Å; Q488-S490 VanDerWaalsContact C-N 3.34Å; Q488-S490 PolarHBondContact O-N 2.77Å; Q488-R491 PolarHBondContact O-N 3.36Å; Q488-T492 WeakPolarHBondContact O-CB 3.25Å; Q488-T492 PolarHBondContact O-N 2.72Å; Q488-T492 PolarHBondContact O-OG1 2.67Å
489	T	92.4	Very high	90.2	Very high	15 Å²	15	41.8 Å²	41.8	9%	0.092	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-42.9	177.8	-52.2	0	0	0	0	110.6	L387 Y388 P485 D486 R491 T492 L493	L387-T489 WeakPolarHBondContact O-CG2 3.08Å; Y388-T489 HydrophobicContact CD2-CG2 3.76Å; Y388-T489 HydrophobicContact CE2-CG2 4.05Å; Y388-T489 HydrophobicContact CG-CG2 4.21Å; P485-T489 HydrophobicContact CB-CG2 3.95Å; D486-T489 PolarHBondContact O-N 3.33Å; D486-T489 VanDerWaalsContact OD1-CB 3.31Å; D486-T489 WeakPolarHBondContact OD1-CB 3.04Å; D486-T489 PolarHBondContact OD1-N 2.83Å; D486-T489 PolarHBondContact OD1-OG1 3.21Å; T489-R491 PolarHBondContact O-N 3.19Å; T489-T492 PolarHBondContact O-N 3.35Å; T489-L493 HydrophobicContact CG2-CD1 3.94Å; T489-L493 HydrophobicContact CG2-CG 4.34Å; T489-L493 WeakPolarHBondContact O-CB 3.46Å; T489-L493 VanDerWaalsContact O-CG 3.26Å; T489-L493 WeakPolarHBondContact O-CG 3.26Å; T489-L493 PolarHBondContact O-N 2.97Å
490	S	92.8	Very high	90.8	Very high	30 Å²	30	37 Å²	37	21%	0.21	18%	0.181	C	C	.	.	H	α-helix	trans	-63.1	-40.7	177.1	-173.2	0	0	0	0	112.3	D486 Q488 T494	D486-S490 WeakPolarHBondContact O-CB 3.24Å; D486-S490 PolarHBondContact O-N 2.67Å; Q488-S490 VanDerWaalsContact C-N 3.34Å; Q488-S490 PolarHBondContact O-N 2.77Å; S490-T494 WeakPolarHBondContact O-CB 3.41Å; S490-T494 PolarHBondContact O-N 3.16Å; S490-T494 PolarHBondContact O-OG1 2.92Å
491	R	94	Very high	91.2	Very high	47 Å²	47	37.5 Å²	37.5	18%	0.177	18%	0.184	C	C	.	.	H	α-helix	trans	-63.8	-45.5	173.6	179.9	56.6	168.1	169.6	1.7	111.6	E395 E487 Q488 T489 T494 L495	E395-R491 VanDerWaalsContact CD-NE 3.26Å; E395-R491 IonicContact OE1-CZ 3.23Å; E395-R491 VanDerWaalsContact OE1-CZ 3.3Å; E395-R491 IonicContact OE1-NE 3.46Å; E395-R491 PolarHBondContact OE1-NE 3.13Å; E395-R491 IonicContact OE1-NH2 2.72Å; E395-R491 PolarHBondContact OE1-NH2 3.22Å; E395-R491 IonicContact OE2-CZ 2.78Å; E395-R491 IonicContact OE2-NE 3.86Å; E395-R491 PolarHBondContact OE2-NE 3.4Å; E395-R491 IonicContact OE2-NH2 3.93Å; E395-R491 PolarHBondContact OE2-NH2 3.05Å; E487-R491 VanDerWaalsContact O-CB 3.26Å; E487-R491 WeakPolarHBondContact O-CB 3.45Å; E487-R491 PolarHBondContact O-N 2.91Å; Q488-R491 PolarHBondContact O-N 3.36Å; T489-R491 PolarHBondContact O-N 3.19Å; R491-T494 WeakPolarHBondContact O-CB 3.4Å; R491-T494 PolarHBondContact O-N 3.07Å; R491-L495 HydrophobicContact CG-CD1 4.11Å; R491-L495 WeakPolarHBondContact O-CG 3.23Å; R491-L495 PolarHBondContact O-N 3.02Å
492	T	95.2	Very high	91.7	Very high	8 Å²	8	37.6 Å²	37.6	5%	0.049	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-49.8	177.9	-62.6	0	0	0	0	111.7	L387 C394 Q488 T489 T494 L495 I496	L387-T492 HydrophobicContact CD2-CG2 4.38Å; C394-T492 HydrophobicContact CB-CG2 3.84Å; Q488-T492 WeakPolarHBondContact O-CB 3.25Å; Q488-T492 PolarHBondContact O-N 2.72Å; Q488-T492 PolarHBondContact O-OG1 2.67Å; T489-T492 PolarHBondContact O-N 3.35Å; T492-T494 VanDerWaalsContact C-N 3.31Å; T492-T494 PolarHBondContact O-N 3.27Å; T492-L495 PolarHBondContact O-N 3.27Å; T492-L495 VanDerWaalsContact O-N 3.14Å; T492-I496 HydrophobicContact CG2-CD1 3.77Å; T492-I496 WeakPolarHBondContact O-CG1 3.45Å; T492-I496 PolarHBondContact O-N 2.95Å
493	L	96.1	Very high	92.5	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.2	-40.9	174.9	-71.7	169.9	0	0	0	112.4	I384 L387 Y388 I472 P475 P485 T489 L495 I496 A497	I384-L493 HydrophobicContact CG1-CD2 4.39Å; L387-L493 HydrophobicContact CD1-CD2 3.59Å; Y388-L493 HydrophobicContact CE2-CD1 4.01Å; I472-L493 HydrophobicContact CG2-CB 4.46Å; I472-L493 HydrophobicContact CG2-CD2 4.03Å; I472-L493 WeakPolarHBondContact O-CB 3.22Å; I472-L493 WeakPolarHBondContact O-CD2 3.37Å; P475-L493 HydrophobicContact CG-CD1 4Å; P485-L493 HydrophobicContact CB-CD1 4.29Å; P485-L493 HydrophobicContact CG-CD1 4.49Å; T489-L493 HydrophobicContact CG2-CD1 3.94Å; T489-L493 HydrophobicContact CG2-CG 4.34Å; T489-L493 WeakPolarHBondContact O-CB 3.46Å; T489-L493 VanDerWaalsContact O-CG 3.26Å; T489-L493 WeakPolarHBondContact O-CG 3.26Å; T489-L493 PolarHBondContact O-N 2.97Å; L493-L495 PolarHBondContact O-N 3.49Å; L493-I496 PolarHBondContact O-N 2.87Å; L493-A497 VanDerWaalsContact O-CB 3.32Å; L493-A497 WeakPolarHBondContact O-CB 3.25Å; L493-A497 PolarHBondContact O-N 3.15Å
494	T	96	Very high	93.1	Very high	39 Å²	39	31.7 Å²	31.7	24%	0.239	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-41.4	175.9	-59	0	0	0	0	111.8	S490 R491 T492 K498	S490-T494 WeakPolarHBondContact O-CB 3.41Å; S490-T494 PolarHBondContact O-N 3.16Å; S490-T494 PolarHBondContact O-OG1 2.92Å; R491-T494 WeakPolarHBondContact O-CB 3.4Å; R491-T494 PolarHBondContact O-N 3.07Å; T492-T494 VanDerWaalsContact C-N 3.31Å; T492-T494 PolarHBondContact O-N 3.27Å; T494-K498 WeakPolarHBondContact O-CG 3.31Å; T494-K498 PolarHBondContact O-N 3.34Å
495	L	96.4	Very high	93.6	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-70.8	-42	180	-69	167.1	0	0	0	111.7	C394 V396 L413 R491 T492 L493 K498 V499 Y515 M516	C394-L495 WeakPolarHBondContact O-CD1 3.41Å; V396-L495 HydrophobicContact CG2-CD1 4.26Å; V396-L495 HydrophobicContact CG2-CD2 4.45Å; L413-L495 HydrophobicContact CD1-CB 3.81Å; L413-L495 HydrophobicContact CD2-CB 3.97Å; L413-L495 HydrophobicContact CD2-CD1 4.4Å; R491-L495 HydrophobicContact CG-CD1 4.11Å; R491-L495 WeakPolarHBondContact O-CG 3.23Å; R491-L495 PolarHBondContact O-N 3.02Å; T492-L495 PolarHBondContact O-N 3.27Å; T492-L495 VanDerWaalsContact O-N 3.14Å; L493-L495 PolarHBondContact O-N 3.49Å; L495-K498 WeakPolarHBondContact O-CB 3.18Å; L495-K498 PolarHBondContact O-N 3.5Å; L495-V499 WeakPolarHBondContact O-CG2 3.08Å; L495-V499 PolarHBondContact O-N 3.27Å; L495-V499 VanDerWaalsContact O-N 3.08Å; L495-Y515 HydrophobicContact CD2-CE2 4.13Å; L495-M516 HydrophobicContact CD2-CE 4.46Å; L495-M516 HydrophobicContact CD2-SD 3.81Å
496	I	96.9	Very high	93.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-48.2	173.6	-63.9	159.8	0	0	0	110.3	F383 L387 L413 C416 A420 I472 T492 L493 K498 V499 V500	F383-I496 HydrophobicContact CE1-CG2 4.5Å; F383-I496 HydrophobicContact CZ-CD1 4.15Å; L387-I496 HydrophobicContact CD1-CD1 3.63Å; L387-I496 HydrophobicContact CD2-CD1 4.47Å; L413-I496 HydrophobicContact CD1-CG1 3.88Å; C416-I496 HydrophobicContact CB-CD1 3.7Å; C416-I496 HydrophobicContact CB-CG1 3.96Å; A420-I496 HydrophobicContact CB-CG2 3.95Å; I472-I496 HydrophobicContact CG2-CG2 4.34Å; T492-I496 HydrophobicContact CG2-CD1 3.77Å; T492-I496 WeakPolarHBondContact O-CG1 3.45Å; T492-I496 PolarHBondContact O-N 2.95Å; L493-I496 PolarHBondContact O-N 2.87Å; I496-K498 VanDerWaalsContact C-N 3.31Å; I496-K498 PolarHBondContact O-N 2.95Å; I496-V499 PolarHBondContact O-N 3.1Å; I496-V499 VanDerWaalsContact O-N 3.16Å; I496-V500 HydrophobicContact CG2-CG2 4.29Å; I496-V500 WeakPolarHBondContact O-CG2 3.48Å; I496-V500 PolarHBondContact O-N 3.25Å
497	A	97	Very high	94.2	Very high	3 Å²	3	32.5 Å²	32.5	3%	0.025	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-36.9	177.5	0	0	0	0	0	112.7	C469 I472 M473 L493 Q501	C469-A497 HydrophobicContact CB-CB 4.46Å; I472-A497 HydrophobicContact CB-CB 4.24Å; I472-A497 HydrophobicContact CG2-CB 3.99Å; M473-A497 HydrophobicContact CG-CB 3.36Å; M473-A497 HydrophobicContact SD-CB 4.21Å; L493-A497 VanDerWaalsContact O-CB 3.32Å; L493-A497 WeakPolarHBondContact O-CB 3.25Å; L493-A497 PolarHBondContact O-N 3.15Å; A497-Q501 WeakPolarHBondContact O-CB 3.39Å; A497-Q501 PolarHBondContact O-N 3.18Å
498	K	96	Very high	94.5	Very high	43 Å²	43	28.9 Å²	28.9	19%	0.187	15%	0.146	C	C	.	.	H	α-helix	trans	-63.1	-42.5	173.2	-80.5	-172.5	-178.8	-164.4	0	113	T494 L495 I496 N502 E513 Y515	T494-K498 WeakPolarHBondContact O-CG 3.31Å; T494-K498 PolarHBondContact O-N 3.34Å; L495-K498 WeakPolarHBondContact O-CB 3.18Å; L495-K498 PolarHBondContact O-N 3.5Å; I496-K498 VanDerWaalsContact C-N 3.31Å; I496-K498 PolarHBondContact O-N 2.95Å; K498-N502 PolarHBondContact O-N 3.31Å; K498-N502 PolarHBondContact O-ND2 3.24Å; K498-E513 IonicContact NZ-OE1 3.92Å; K498-E513 PolarHBondContact NZ-OE1 3.26Å; K498-Y515 PolarHBondContact NZ-OH 3.38Å
499	V	96.8	Very high	94.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.8	-50.5	178.1	175.9	0	0	0	0	110	C417 L495 I496 Q501 N502 L503 F509 M516 M519 F522 L523	C417-V499 HydrophobicContact CB-CG1 4.09Å; L495-V499 WeakPolarHBondContact O-CG2 3.08Å; L495-V499 PolarHBondContact O-N 3.27Å; L495-V499 VanDerWaalsContact O-N 3.08Å; I496-V499 PolarHBondContact O-N 3.1Å; I496-V499 VanDerWaalsContact O-N 3.16Å; V499-Q501 VanDerWaalsContact C-N 3.27Å; V499-Q501 PolarHBondContact O-N 3.38Å; V499-N502 PolarHBondContact O-N 2.68Å; V499-N502 VanDerWaalsContact O-N 3.13Å; V499-L503 PolarHBondContact O-N 3.2Å; V499-F509 HydrophobicContact CG2-CE2 4.13Å; V499-F509 HydrophobicContact CG2-CZ 4.06Å; V499-M516 HydrophobicContact CG2-CE 3.5Å; V499-M519 HydrophobicContact CG1-CE 3.74Å; V499-M519 HydrophobicContact CG2-CB 4.48Å; V499-M519 HydrophobicContact CG2-CE 4.09Å; V499-M519 HydrophobicContact CG2-CG 4.12Å; V499-F522 HydrophobicContact CG1-CD1 3.92Å; V499-F522 HydrophobicContact CG1-CE1 3.68Å; V499-L523 HydrophobicContact CG1-CD2 3.98Å
500	V	96.8	Very high	94.7	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.018	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-38.7	177.9	174.4	0	0	0	0	111.4	I424 F464 I496 L503 A504	I424-V500 HydrophobicContact CD1-CG1 4.33Å; F464-V500 HydrophobicContact CD1-CG1 3.71Å; F464-V500 HydrophobicContact CE1-CG1 3.83Å; I496-V500 HydrophobicContact CG2-CG2 4.29Å; I496-V500 WeakPolarHBondContact O-CG2 3.48Å; I496-V500 PolarHBondContact O-N 3.25Å; V500-L503 PolarHBondContact O-N 3.42Å; V500-A504 VanDerWaalsContact O-CB 3.29Å; V500-A504 WeakPolarHBondContact O-CB 3.38Å; V500-A504 PolarHBondContact O-N 3.42Å
501	Q	95.4	Very high	94.1	Very high	20 Å²	20	31.1 Å²	31.1	9%	0.093	18%	0.176	C	C	.	.	H	α-helix	trans	-68.5	-37.4	176.4	-170	59.1	60.3	0	0	113.3	L465 C469 A497 V499 N505	L465-Q501 HydrophobicContact CD1-CG 4.5Å; C469-Q501 PolarHBondContact SG-OE1 3.41Å; A497-Q501 WeakPolarHBondContact O-CB 3.39Å; A497-Q501 PolarHBondContact O-N 3.18Å; V499-Q501 VanDerWaalsContact C-N 3.27Å; V499-Q501 PolarHBondContact O-N 3.38Å; Q501-N505 PolarHBondContact NE2-OD1 3.19Å; Q501-N505 VanDerWaalsContact O-CB 3.3Å; Q501-N505 WeakPolarHBondContact O-CB 3.4Å; Q501-N505 PolarHBondContact O-N 3.41Å; Q501-N505 PolarHBondContact O-ND2 3.45Å; Q501-N505 PolarHBondContact O-OD1 3.03Å
502	N	94.6	Very high	93.7	Very high	27 Å²	27	38.7 Å²	38.7	14%	0.144	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-40.5	175	-87.9	-84	0	0	0	111.4	K498 V499 N505 F506 S507 F509 L523	K498-N502 PolarHBondContact O-N 3.31Å; K498-N502 PolarHBondContact O-ND2 3.24Å; V499-N502 PolarHBondContact O-N 2.68Å; V499-N502 VanDerWaalsContact O-N 3.13Å; N502-N505 CarbonylContact O-C 3.59Å; N502-N505 PolarHBondContact O-N 3.41Å; N502-F506 PolarHBondContact O-N 3.42Å; N502-F506 VanDerWaalsContact O-N 3.1Å; N502-S507 WeakPolarHBondContact CB-O 3.43Å; N502-S507 PolarHBondContact O-N 3.05Å; N502-S507 PolarHBondContact O-OG 3.08Å; N502-S507 PolarHBondContact OD1-OG 2.92Å; N502-F509 HydrophobicContact CB-CE2 4.42Å; N502-F509 HydrophobicContact CB-CZ 4.24Å; N502-F509 VanDerWaalsContact ND2-CE1 3.32Å; N502-F509 WeakPolarHBondContact ND2-CE1 3.46Å; N502-L523 HydrophobicContact CB-CD1 4.07Å; N502-L523 HydrophobicContact CB-CD2 4.4Å
503	L	95.4	Very high	93.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-59.5	-49.2	173.9	-173	68.7	0	0	0	111.5	L421 V499 V500 N505 F506 L523 E526 M530	L421-L503 HydrophobicContact CD1-CD2 3.55Å; L421-L503 HydrophobicContact CD2-CD2 3.67Å; L421-L503 HydrophobicContact CG-CD2 4.2Å; V499-L503 PolarHBondContact O-N 3.2Å; V500-L503 PolarHBondContact O-N 3.42Å; L503-N505 VanDerWaalsContact C-N 3.26Å; L503-N505 PolarHBondContact O-N 3.43Å; L503-F506 PolarHBondContact O-N 2.88Å; L503-L523 HydrophobicContact CB-CD2 3.64Å; L503-L523 HydrophobicContact CD1-CD2 4.02Å; L503-L523 WeakPolarHBondContact CD1-O 3.39Å; L503-L523 HydrophobicContact CG-CD2 4.41Å; L503-E526 HydrophobicContact CD1-CB 3.79Å; L503-E526 HydrophobicContact CD2-CB 4.18Å; L503-M530 HydrophobicContact CB-CE 4.35Å; L503-M530 HydrophobicContact CD2-CB 4.44Å; L503-M530 HydrophobicContact CD2-CE 3.6Å; L503-M530 HydrophobicContact CG-CB 4.11Å; L503-M530 HydrophobicContact CG-CE 3.81Å; L503-M530 HydrophobicContact CG-CG 4.32Å
504	A	93.2	Very high	93	Very high	2 Å²	2	47.7 Å²	47.7	2%	0.017	25%	0.252	C	S	.	.	H	α-helix	trans	-65.2	-26.1	177.9	0	0	0	0	0	113.6	S460 F464 V500 F506 M530	S460-A504 WeakPolarHBondContact OG-CB 3.28Å; S460-A504 PolarHBondContact OG-O 3.42Å; F464-A504 HydrophobicContact CB-CB 3.68Å; F464-A504 HydrophobicContact CD1-CB 3.9Å; F464-A504 HydrophobicContact CD2-CB 3.55Å; F464-A504 HydrophobicContact CE1-CB 4.44Å; F464-A504 HydrophobicContact CE2-CB 4.14Å; F464-A504 HydrophobicContact CG-CB 3.41Å; F464-A504 VanDerWaalsContact CG-CB 3.41Å; V500-A504 VanDerWaalsContact O-CB 3.29Å; V500-A504 WeakPolarHBondContact O-CB 3.38Å; V500-A504 PolarHBondContact O-N 3.42Å; A504-F506 VanDerWaalsContact C-N 3.34Å; A504-M530 HydrophobicContact CB-CE 4.32Å; A504-M530 HydrophobicContact CB-SD 4.36Å
505	N	91.4	Very high	92.8	Very high	86 Å²	86	48.4 Å²	48.4	46%	0.46	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-5.1	172.5	-70.4	-11.2	0	0	0	113.4	Q501 N502 L503 S507	Q501-N505 PolarHBondContact NE2-OD1 3.19Å; Q501-N505 VanDerWaalsContact O-CB 3.3Å; Q501-N505 WeakPolarHBondContact O-CB 3.4Å; Q501-N505 PolarHBondContact O-N 3.41Å; Q501-N505 PolarHBondContact O-ND2 3.45Å; Q501-N505 PolarHBondContact O-OD1 3.03Å; N502-N505 CarbonylContact O-C 3.59Å; N502-N505 PolarHBondContact O-N 3.41Å; L503-N505 VanDerWaalsContact C-N 3.26Å; L503-N505 PolarHBondContact O-N 3.43Å; N505-S507 WeakPolarHBondContact CB-OG 3.41Å; N505-S507 PolarHBondContact O-N 3.02Å
506	F	91.9	Very high	92.7	Very high	75 Å²	75	48.4 Å²	48.4	33%	0.329	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	33.4	-168.6	-57.4	-87.2	0	0	0	113.4	N502 L503 A504 W527 M530 Q531 L534	N502-F506 PolarHBondContact O-N 3.42Å; N502-F506 VanDerWaalsContact O-N 3.1Å; L503-F506 PolarHBondContact O-N 2.88Å; A504-F506 VanDerWaalsContact C-N 3.34Å; F506-W527 HydrophobicContact CD1-CB 4.11Å; F506-W527 AromaticContact CD1-CD1 3.68Å; F506-W527 AromaticContact CD1-CG 3.98Å; F506-W527 HydrophobicContact CD1-CG 3.98Å; F506-W527 HydrophobicContact CE1-CB 4.32Å; F506-M530 HydrophobicContact CE1-CB 4.28Å; F506-M530 HydrophobicContact CE1-CG 4.19Å; F506-M530 HydrophobicContact CZ-CB 4.38Å; F506-M530 HydrophobicContact CZ-CG 3.89Å; F506-Q531 HydrophobicContact CE1-CB 4.1Å; F506-Q531 HydrophobicContact CZ-CB 4.07Å; F506-L534 HydrophobicContact CE2-CD1 3.83Å; F506-L534 HydrophobicContact CZ-CD1 3.89Å
507	S	92.8	Very high	92.6	Very high	37 Å²	37	50.6 Å²	50.6	26%	0.259	27%	0.265	S	S	.	.			trans	-110.9	143.6	-176.9	61.8	0	0	0	0	112.6	N502 N505	N502-S507 WeakPolarHBondContact CB-O 3.43Å; N502-S507 PolarHBondContact O-N 3.05Å; N502-S507 PolarHBondContact O-OG 3.08Å; N502-S507 PolarHBondContact OD1-OG 2.92Å; N505-S507 WeakPolarHBondContact CB-OG 3.41Å; N505-S507 PolarHBondContact O-N 3.02Å
508	K	94	Very high	92.4	Very high	99 Å²	99	53.2 Å²	53.2	43%	0.43	28%	0.276	S	S	.	.			trans	-88.2	153.1	170.2	-58.4	-170.5	-171.5	-166.1	0	111	E524 W527	K508-E524 HydrophobicContact CD-CG 4.41Å; K508-E524 WeakPolarHBondContact CE-OE1 3.5Å; K508-E524 IonicContact NZ-OE1 2.67Å; K508-E524 PolarHBondContact NZ-OE1 3.34Å; K508-E524 IonicContact NZ-OE2 2.78Å; K508-E524 PolarHBondContact NZ-OE2 3.41Å; K508-W527 HydrophobicContact CG-CH2 4.21Å; K508-W527 HydrophobicContact CG-CZ2 3.95Å
509	F	94.8	Very high	92.4	Very high	8 Å²	8	51.2 Å²	51.2	4%	0.035	27%	0.267	C	S	.	.			trans	-65.9	134.2	163.8	-65.3	-77.8	0	0	0	110	V499 N502 E513 M516 M519 N520 L523	V499-F509 HydrophobicContact CG2-CE2 4.13Å; V499-F509 HydrophobicContact CG2-CZ 4.06Å; N502-F509 HydrophobicContact CB-CE2 4.42Å; N502-F509 HydrophobicContact CB-CZ 4.24Å; N502-F509 VanDerWaalsContact ND2-CE1 3.32Å; N502-F509 WeakPolarHBondContact ND2-CE1 3.46Å; F509-E513 HydrophobicContact CD1-CB 4.21Å; F509-M516 HydrophobicContact CB-CB 4.04Å; F509-M516 HydrophobicContact CD1-CB 3.44Å; F509-M516 VanDerWaalsContact CD1-CB 3.44Å; F509-M516 HydrophobicContact CD1-CG 4.03Å; F509-M516 HydrophobicContact CD2-CB 3.75Å; F509-M516 HydrophobicContact CE1-CB 3.71Å; F509-M516 HydrophobicContact CE1-CE 4.11Å; F509-M516 HydrophobicContact CE1-CG 3.9Å; F509-M516 HydrophobicContact CE2-CB 4Å; F509-M516 HydrophobicContact CE2-CE 3.97Å; F509-M516 HydrophobicContact CG-CB 3.46Å; F509-M516 VanDerWaalsContact CG-CB 3.46Å; F509-M516 HydrophobicContact CG-CG 4.5Å; F509-M516 HydrophobicContact CZ-CB 3.99Å; F509-M516 HydrophobicContact CZ-CE 3.58Å; F509-M516 HydrophobicContact CZ-CG 4.28Å; F509-M519 HydrophobicContact CD2-CB 4.27Å; F509-M519 HydrophobicContact CE2-CB 4.04Å; F509-N520 PolarHBondContact N-OD1 3.4Å; F509-N520 PolarHBondContact O-ND2 3.44Å; F509-L523 HydrophobicContact CD2-CD1 3.75Å; F509-L523 HydrophobicContact CE2-CD1 3.78Å
510	G	90.3	Very high	92.4	Very high	42 Å²	42	52.3 Å²	52.3	43%	0.433	27%	0.273	S	S	.	.			trans	-121	-171.5	176.7	0	0	0	0	0	112.2	K512 E513	G510-K512 PolarHBondContact O-N 2.99Å; G510-E513 CarbonylContact O-C 3.49Å; G510-E513 PolarHBondContact O-N 3.06Å
511	S	81.7	Confident	92.3	Very high	114 Å²	114	58.1 Å²	58.1	80%	0.797	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-56.5	-12.7	-171.7	55.5	0	0	0	0	116.9	E513	S511-E513 VanDerWaalsContact C-N 3.33Å
512	K	85.2	Confident	92.4	Very high	206 Å²	206	57.3 Å²	57.3	90%	0.896	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-73.9	-23	171.6	-66.3	-176.3	179.1	179.5	0	113.5	G510	G510-K512 PolarHBondContact O-N 2.99Å
513	E	88.8	Confident	92.5	Very high	47 Å²	47	56 Å²	56	22%	0.22	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-137.5	48.8	-178.9	-59.1	-161.6	121.7	0	0	110	K498 F509 G510 S511 Y515 M516	K498-E513 IonicContact NZ-OE1 3.92Å; K498-E513 PolarHBondContact NZ-OE1 3.26Å; F509-E513 HydrophobicContact CD1-CB 4.21Å; G510-E513 CarbonylContact O-C 3.49Å; G510-E513 PolarHBondContact O-N 3.06Å; S511-E513 VanDerWaalsContact C-N 3.33Å; E513-Y515 HydrophobicContact CB-CE1 4.2Å; E513-Y515 PolarHBondContact O-N 3.18Å; E513-M516 HydrophobicContact CB-CB 4.47Å; E513-M516 HydrophobicContact CB-CG 4.35Å; E513-M516 WeakPolarHBondContact O-CB 3.24Å; E513-M516 PolarHBondContact O-N 3.11Å
514	E	88.7	Confident	92.5	Very high	150 Å²	150	60 Å²	60	70%	0.701	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-52.2	-33.8	-173.6	-174.5	172	-159.4	0	0	113.7	M516 C517	E514-M516 PolarHBondContact O-N 3.08Å; E514-M516 VanDerWaalsContact O-N 3.14Å; E514-C517 VanDerWaalsContact O-CB 3.3Å; E514-C517 WeakPolarHBondContact O-CB 3.44Å; E514-C517 PolarHBondContact O-N 3.15Å
515	Y	91.4	Very high	92.6	Very high	53 Å²	53	64.9 Å²	64.9	21%	0.208	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-62.1	-17.3	175.9	77	-87	0	0	0	114.5	V396 L495 K498 E513 F518	V396-Y515 HydrophobicContact CG2-CD2 4.01Å; V396-Y515 HydrophobicContact CG2-CE2 4.15Å; L495-Y515 HydrophobicContact CD2-CE2 4.13Å; K498-Y515 PolarHBondContact NZ-OH 3.38Å; E513-Y515 HydrophobicContact CB-CE1 4.2Å; E513-Y515 PolarHBondContact O-N 3.18Å; Y515-F518 WeakPolarHBondContact O-CD1 3.46Å; Y515-F518 WeakPolarHBondContact O-CE1 3.33Å
516	M	93.8	Very high	92.9	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-95.3	-8.6	175.5	-64	-64.4	-62.7	0	0	113.6	V396 L413 L495 V499 F509 E513 E514 F518 M519	V396-M516 HydrophobicContact CG2-SD 3.95Å; L413-M516 HydrophobicContact CD2-CE 4.21Å; L495-M516 HydrophobicContact CD2-CE 4.46Å; L495-M516 HydrophobicContact CD2-SD 3.81Å; V499-M516 HydrophobicContact CG2-CE 3.5Å; F509-M516 HydrophobicContact CB-CB 4.04Å; F509-M516 HydrophobicContact CD1-CB 3.44Å; F509-M516 VanDerWaalsContact CD1-CB 3.44Å; F509-M516 HydrophobicContact CD1-CG 4.03Å; F509-M516 HydrophobicContact CD2-CB 3.75Å; F509-M516 HydrophobicContact CE1-CB 3.71Å; F509-M516 HydrophobicContact CE1-CE 4.11Å; F509-M516 HydrophobicContact CE1-CG 3.9Å; F509-M516 HydrophobicContact CE2-CB 4Å; F509-M516 HydrophobicContact CE2-CE 3.97Å; F509-M516 HydrophobicContact CG-CB 3.46Å; F509-M516 VanDerWaalsContact CG-CB 3.46Å; F509-M516 HydrophobicContact CG-CG 4.5Å; F509-M516 HydrophobicContact CZ-CB 3.99Å; F509-M516 HydrophobicContact CZ-CE 3.58Å; F509-M516 HydrophobicContact CZ-CG 4.28Å; E513-M516 HydrophobicContact CB-CB 4.47Å; E513-M516 HydrophobicContact CB-CG 4.35Å; E513-M516 WeakPolarHBondContact O-CB 3.24Å; E513-M516 PolarHBondContact O-N 3.11Å; E514-M516 PolarHBondContact O-N 3.08Å; E514-M516 VanDerWaalsContact O-N 3.14Å; M516-F518 PolarHBondContact O-N 2.82Å; M516-M519 HydrophobicContact CE-CG 4.38Å; M516-M519 WeakPolarHBondContact O-CB 3.46Å; M516-M519 PolarHBondContact O-N 2.81Å
517	C	93.9	Very high	93	Very high	46 Å²	46	62.4 Å²	62.4	31%	0.311	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-59.5	-22.5	-172.5	-75.3	0	0	0	0	114.4	E514 M519 N520	E514-C517 VanDerWaalsContact O-CB 3.3Å; E514-C517 WeakPolarHBondContact O-CB 3.44Å; E514-C517 PolarHBondContact O-N 3.15Å; C517-M519 PolarHBondContact O-N 3.48Å; C517-N520 VanDerWaalsContact O-CB 3.28Å; C517-N520 WeakPolarHBondContact O-CB 3.41Å; C517-N520 PolarHBondContact O-N 2.9Å; C517-N520 VanDerWaalsContact O-N 3.09Å; C517-N520 PolarHBondContact O-ND2 3.03Å
518	F	94.5	Very high	93.1	Very high	58 Å²	58	62.9 Å²	62.9	25%	0.254	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-62.7	-24	174	78.8	-82.9	0	0	0	113.1	V396 Q410 L413 Y515 M516 N520	V396-F518 HydrophobicContact CB-CE1 4.14Å; V396-F518 HydrophobicContact CB-CZ 4.41Å; V396-F518 HydrophobicContact CG1-CE1 4.23Å; V396-F518 HydrophobicContact CG1-CZ 4Å; V396-F518 HydrophobicContact CG2-CE1 4.19Å; V396-F518 HydrophobicContact CG2-CZ 4.49Å; Q410-F518 HydrophobicContact CB-CD2 3.91Å; Q410-F518 HydrophobicContact CB-CE2 3.5Å; Q410-F518 VanDerWaalsContact CB-CE2 3.5Å; Q410-F518 HydrophobicContact CB-CZ 3.87Å; Q410-F518 HydrophobicContact CG-CD1 4.07Å; Q410-F518 HydrophobicContact CG-CD2 3.94Å; Q410-F518 HydrophobicContact CG-CE1 3.8Å; Q410-F518 HydrophobicContact CG-CE2 3.65Å; Q410-F518 HydrophobicContact CG-CG 4.15Å; Q410-F518 HydrophobicContact CG-CZ 3.58Å; L413-F518 HydrophobicContact CD2-CZ 4.21Å; Y515-F518 WeakPolarHBondContact O-CD1 3.46Å; Y515-F518 WeakPolarHBondContact O-CE1 3.33Å; M516-F518 PolarHBondContact O-N 2.82Å; F518-N520 VanDerWaalsContact C-N 3.27Å; F518-N520 PolarHBondContact O-N 3.37Å
519	M	96	Very high	93.1	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-77.1	-8.5	175.2	-68.2	-60	-68	0	0	113.4	R414 C417 V499 F509 M516 C517 E521 F522 L523	R414-M519 HydrophobicContact CB-CE 4.33Å; R414-M519 HydrophobicContact CB-SD 4.06Å; R414-M519 HydrophobicContact CG-CE 4.48Å; C417-M519 HydrophobicContact CB-CE 3.93Å; V499-M519 HydrophobicContact CG1-CE 3.74Å; V499-M519 HydrophobicContact CG2-CB 4.48Å; V499-M519 HydrophobicContact CG2-CE 4.09Å; V499-M519 HydrophobicContact CG2-CG 4.12Å; F509-M519 HydrophobicContact CD2-CB 4.27Å; F509-M519 HydrophobicContact CE2-CB 4.04Å; M516-M519 HydrophobicContact CE-CG 4.38Å; M516-M519 WeakPolarHBondContact O-CB 3.46Å; M516-M519 PolarHBondContact O-N 2.81Å; C517-M519 PolarHBondContact O-N 3.48Å; M519-E521 VanDerWaalsContact C-N 3.3Å; M519-E521 PolarHBondContact O-N 2.94Å; M519-F522 HydrophobicContact CE-CB 4.2Å; M519-F522 HydrophobicContact CE-CD1 3.54Å; M519-F522 HydrophobicContact CE-CE1 4.15Å; M519-F522 HydrophobicContact CE-CG 3.97Å; M519-F522 WeakPolarHBondContact O-CB 3.21Å; M519-F522 PolarHBondContact O-N 3.5Å; M519-F522 VanDerWaalsContact O-N 3.15Å; M519-L523 WeakPolarHBondContact O-CG 3.45Å; M519-L523 PolarHBondContact O-N 3.08Å
520	N	95.8	Very high	93.2	Very high	23 Å²	23	59.9 Å²	59.9	12%	0.123	32%	0.319	C	S	.	.	H	α-helix	trans	-62.2	-35.6	-177.7	-73.2	-21	0	0	0	112.7	F509 C517 F518 F522 L523 E524	F509-N520 PolarHBondContact N-OD1 3.4Å; F509-N520 PolarHBondContact O-ND2 3.44Å; C517-N520 VanDerWaalsContact O-CB 3.28Å; C517-N520 WeakPolarHBondContact O-CB 3.41Å; C517-N520 PolarHBondContact O-N 2.9Å; C517-N520 VanDerWaalsContact O-N 3.09Å; C517-N520 PolarHBondContact O-ND2 3.03Å; F518-N520 VanDerWaalsContact C-N 3.27Å; F518-N520 PolarHBondContact O-N 3.37Å; N520-F522 PolarHBondContact O-N 3.08Å; N520-L523 PolarHBondContact O-N 2.72Å; N520-E524 WeakPolarHBondContact O-CB 3.43Å; N520-E524 VanDerWaalsContact O-CG 3.24Å; N520-E524 WeakPolarHBondContact O-CG 3.27Å; N520-E524 PolarHBondContact O-N 3.13Å
521	E	95.6	Very high	93.3	Very high	126 Å²	126	63.1 Å²	63.1	59%	0.589	32%	0.322	S	S	*	.	H	α-helix	trans	-59.1	-45.1	173.9	-174.2	-163	-122.1	0	0	111.8	R414 M519 E524 M525	R414-E521 IonicContact CZ-OE2 3.18Å; R414-E521 IonicContact NH1-OE2 2.71Å; R414-E521 PolarHBondContact NH1-OE2 3.36Å; R414-E521 IonicContact NH2-OE2 2.7Å; R414-E521 PolarHBondContact NH2-OE2 2.96Å; M519-E521 VanDerWaalsContact C-N 3.3Å; M519-E521 PolarHBondContact O-N 2.94Å; E521-E524 PolarHBondContact O-N 3.28Å; E521-M525 WeakPolarHBondContact O-CB 3.21Å; E521-M525 PolarHBondContact O-N 3.42Å
522	F	96.3	Very high	93.8	Very high	3 Å²	3	62.3 Å²	62.3	1%	0.013	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-42.2	175.7	165.3	-97.6	0	0	0	111.8	C417 E418 L421 V499 M519 N520 E524 M525 E526	C417-F522 HydrophobicContact CB-CE1 3.98Å; C417-F522 HydrophobicContact CB-CZ 4.1Å; E418-F522 HydrophobicContact CB-CE2 4.33Å; E418-F522 HydrophobicContact CG-CD2 3.74Å; E418-F522 HydrophobicContact CG-CE2 3.39Å; E418-F522 HydrophobicContact CG-CZ 4.33Å; L421-F522 HydrophobicContact CB-CZ 4.49Å; L421-F522 HydrophobicContact CD2-CE2 4.46Å; L421-F522 HydrophobicContact CD2-CZ 4.03Å; V499-F522 HydrophobicContact CG1-CD1 3.92Å; V499-F522 HydrophobicContact CG1-CE1 3.68Å; M519-F522 HydrophobicContact CE-CB 4.2Å; M519-F522 HydrophobicContact CE-CD1 3.54Å; M519-F522 HydrophobicContact CE-CE1 4.15Å; M519-F522 HydrophobicContact CE-CG 3.97Å; M519-F522 WeakPolarHBondContact O-CB 3.21Å; M519-F522 PolarHBondContact O-N 3.5Å; M519-F522 VanDerWaalsContact O-N 3.15Å; N520-F522 PolarHBondContact O-N 3.08Å; F522-E524 PolarHBondContact O-N 2.98Å; F522-M525 HydrophobicContact CD2-CE 4.33Å; F522-M525 PolarHBondContact O-N 2.97Å; F522-E526 HydrophobicContact CD2-CG 4Å; F522-E526 HydrophobicContact CE2-CG 3.61Å; F522-E526 HydrophobicContact CZ-CG 4.06Å; F522-E526 WeakPolarHBondContact O-CB 3.37Å; F522-E526 WeakPolarHBondContact O-CG 3.18Å; F522-E526 PolarHBondContact O-N 3.29Å; F522-E526 VanDerWaalsContact O-N 3.14Å
523	L	96.3	Very high	94.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-43.9	176.6	-66.6	176	0	0	0	111.9	V499 N502 L503 F509 M519 N520 E526 W527	V499-L523 HydrophobicContact CG1-CD2 3.98Å; N502-L523 HydrophobicContact CB-CD1 4.07Å; N502-L523 HydrophobicContact CB-CD2 4.4Å; L503-L523 HydrophobicContact CB-CD2 3.64Å; L503-L523 HydrophobicContact CD1-CD2 4.02Å; L503-L523 WeakPolarHBondContact CD1-O 3.39Å; L503-L523 HydrophobicContact CG-CD2 4.41Å; F509-L523 HydrophobicContact CD2-CD1 3.75Å; F509-L523 HydrophobicContact CE2-CD1 3.78Å; M519-L523 WeakPolarHBondContact O-CG 3.45Å; M519-L523 PolarHBondContact O-N 3.08Å; N520-L523 PolarHBondContact O-N 2.72Å; L523-E526 PolarHBondContact O-N 2.91Å; L523-W527 VanDerWaalsContact O-CG 3.26Å; L523-W527 PolarHBondContact O-N 3.03Å; L523-W527 PolarHBondContact O-NE1 2.83Å
524	E	95.8	Very high	94.5	Very high	85 Å²	85	50.3 Å²	50.3	40%	0.397	25%	0.253	S	S	.	.	H	α-helix	trans	-66.9	-36.4	179.9	-71.7	175	-123.5	0	0	112.7	K508 N520 E521 F522 W527	K508-E524 HydrophobicContact CD-CG 4.41Å; K508-E524 WeakPolarHBondContact CE-OE1 3.5Å; K508-E524 IonicContact NZ-OE1 2.67Å; K508-E524 PolarHBondContact NZ-OE1 3.34Å; K508-E524 IonicContact NZ-OE2 2.78Å; K508-E524 PolarHBondContact NZ-OE2 3.41Å; N520-E524 WeakPolarHBondContact O-CB 3.43Å; N520-E524 VanDerWaalsContact O-CG 3.24Å; N520-E524 WeakPolarHBondContact O-CG 3.27Å; N520-E524 PolarHBondContact O-N 3.13Å; E521-E524 PolarHBondContact O-N 3.28Å; F522-E524 PolarHBondContact O-N 2.98Å; E524-W527 HydrophobicContact CB-CE3 4.43Å; E524-W527 HydrophobicContact CB-CZ3 4.31Å; E524-W527 HydrophobicContact CG-CE3 4.38Å; E524-W527 HydrophobicContact CG-CH2 3.74Å; E524-W527 HydrophobicContact CG-CZ2 4.16Å; E524-W527 HydrophobicContact CG-CZ3 3.84Å
525	M	96	Very high	94.6	Very high	104 Å²	104	48.4 Å²	48.4	51%	0.512	24%	0.24	S	C	.	.	H	α-helix	trans	-66.7	-38.6	176	-172.7	176.9	75.5	0	0	112.4	E521 F522	E521-M525 WeakPolarHBondContact O-CB 3.21Å; E521-M525 PolarHBondContact O-N 3.42Å; F522-M525 HydrophobicContact CD2-CE 4.33Å; F522-M525 PolarHBondContact O-N 2.97Å
526	E	96.3	Very high	94.7	Very high	39 Å²	39	47.7 Å²	47.7	18%	0.182	24%	0.239	C	C	.	.	H	α-helix	trans	-98.2	-1	-169	-69.2	-64.1	168.2	0	0	115.2	L421 L503 F522 L523 G528 S529 M530	L421-E526 HydrophobicContact CD2-CB 3.58Å; L421-E526 HydrophobicContact CD2-CG 3.51Å; L421-E526 WeakPolarHBondContact CD2-OE2 3.35Å; L503-E526 HydrophobicContact CD1-CB 3.79Å; L503-E526 HydrophobicContact CD2-CB 4.18Å; F522-E526 HydrophobicContact CD2-CG 4Å; F522-E526 HydrophobicContact CE2-CG 3.61Å; F522-E526 HydrophobicContact CZ-CG 4.06Å; F522-E526 WeakPolarHBondContact O-CB 3.37Å; F522-E526 WeakPolarHBondContact O-CG 3.18Å; F522-E526 PolarHBondContact O-N 3.29Å; F522-E526 VanDerWaalsContact O-N 3.14Å; L523-E526 PolarHBondContact O-N 2.91Å; E526-G528 PolarHBondContact O-N 3.26Å; E526-S529 WeakPolarHBondContact O-CB 3.23Å; E526-S529 PolarHBondContact O-N 3.14Å; E526-S529 VanDerWaalsContact O-N 3.16Å; E526-S529 WeakPolarHBondContact OE2-CB 3.39Å; E526-S529 PolarHBondContact OE2-OG 3.2Å; E526-M530 PolarHBondContact O-N 3.42Å
527	W	94.3	Very high	94.7	Very high	70 Å²	70	47.7 Å²	47.7	27%	0.265	24%	0.239	S	C	.	.	H	α-helix	trans	-56.2	-38.8	175.7	-73.8	-31.5	0	0	0	112.7	F506 K508 L523 E524 M530 Q531	F506-W527 HydrophobicContact CD1-CB 4.11Å; F506-W527 AromaticContact CD1-CD1 3.68Å; F506-W527 AromaticContact CD1-CG 3.98Å; F506-W527 HydrophobicContact CD1-CG 3.98Å; F506-W527 HydrophobicContact CE1-CB 4.32Å; K508-W527 HydrophobicContact CG-CH2 4.21Å; K508-W527 HydrophobicContact CG-CZ2 3.95Å; L523-W527 VanDerWaalsContact O-CG 3.26Å; L523-W527 PolarHBondContact O-N 3.03Å; L523-W527 PolarHBondContact O-NE1 2.83Å; E524-W527 HydrophobicContact CB-CE3 4.43Å; E524-W527 HydrophobicContact CB-CZ3 4.31Å; E524-W527 HydrophobicContact CG-CE3 4.38Å; E524-W527 HydrophobicContact CG-CH2 3.74Å; E524-W527 HydrophobicContact CG-CZ2 4.16Å; E524-W527 HydrophobicContact CG-CZ3 3.84Å; W527-M530 PolarHBondContact O-N 3.3Å; W527-Q531 WeakPolarHBondContact O-CB 3.07Å; W527-Q531 PolarHBondContact O-N 2.91Å
528	G	95	Very high	94.6	Very high	47 Å²	47	45.6 Å²	45.6	49%	0.485	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-45.3	176.1	0	0	0	0	0	112.4	E526 M530 Q531 Q532	E526-G528 PolarHBondContact O-N 3.26Å; G528-M530 VanDerWaalsContact C-N 3.34Å; G528-M530 PolarHBondContact O-N 3.44Å; G528-Q531 PolarHBondContact O-N 3.42Å; G528-Q532 WeakPolarHBondContact O-CB 3.5Å; G528-Q532 PolarHBondContact O-N 3.22Å
529	S	95.4	Very high	94.2	Very high	43 Å²	43	44.7 Å²	44.7	30%	0.301	22%	0.223	S	C	.	.	H	α-helix	trans	-60	-42.6	175.6	-47.7	0	0	0	0	112	E526 F533	E526-S529 WeakPolarHBondContact O-CB 3.23Å; E526-S529 PolarHBondContact O-N 3.14Å; E526-S529 VanDerWaalsContact O-N 3.16Å; E526-S529 WeakPolarHBondContact OE2-CB 3.39Å; E526-S529 PolarHBondContact OE2-OG 3.2Å; S529-F533 WeakPolarHBondContact O-CB 3.44Å; S529-F533 PolarHBondContact O-N 2.81Å
530	M	95.1	Very high	93.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-44.4	177.4	-179	57.1	67.2	0	0	112.1	L421 F464 L503 A504 F506 E526 W527 G528 F533 L534	L421-M530 HydrophobicContact CD1-CE 3.89Å; F464-M530 HydrophobicContact CE1-CE 3.93Å; F464-M530 HydrophobicContact CE1-SD 4.4Å; F464-M530 HydrophobicContact CE2-CE 4.23Å; F464-M530 HydrophobicContact CE2-SD 3.62Å; F464-M530 HydrophobicContact CZ-CE 3.61Å; F464-M530 HydrophobicContact CZ-SD 3.53Å; F464-M530 VanDerWaalsContact CZ-SD 3.53Å; L503-M530 HydrophobicContact CB-CE 4.35Å; L503-M530 HydrophobicContact CD2-CB 4.44Å; L503-M530 HydrophobicContact CD2-CE 3.6Å; L503-M530 HydrophobicContact CG-CB 4.11Å; L503-M530 HydrophobicContact CG-CE 3.81Å; L503-M530 HydrophobicContact CG-CG 4.32Å; A504-M530 HydrophobicContact CB-CE 4.32Å; A504-M530 HydrophobicContact CB-SD 4.36Å; F506-M530 HydrophobicContact CE1-CB 4.28Å; F506-M530 HydrophobicContact CE1-CG 4.19Å; F506-M530 HydrophobicContact CZ-CB 4.38Å; F506-M530 HydrophobicContact CZ-CG 3.89Å; E526-M530 PolarHBondContact O-N 3.42Å; W527-M530 PolarHBondContact O-N 3.3Å; G528-M530 VanDerWaalsContact C-N 3.34Å; G528-M530 PolarHBondContact O-N 3.44Å; M530-F533 PolarHBondContact O-N 2.66Å; M530-F533 HydrophobicContact SD-CD1 4.42Å; M530-L534 HydrophobicContact CG-CD1 4.27Å; M530-L534 WeakPolarHBondContact O-CB 3.37Å; M530-L534 WeakPolarHBondContact O-CG 3.26Å; M530-L534 PolarHBondContact O-N 3.11Å; M530-L534 HydrophobicContact SD-CD1 4.39Å; M530-L534 HydrophobicContact SD-CG 4.29Å
531	Q	92.5	Very high	92.3	Very high	110 Å²	110	54.4 Å²	54.4	51%	0.514	27%	0.274	S	S	.	.	H	α-helix	trans	-65.3	-43.6	178.7	-170	176.6	10.4	0	0	111.7	F506 W527 G528 L534 Y535	F506-Q531 HydrophobicContact CE1-CB 4.1Å; F506-Q531 HydrophobicContact CZ-CB 4.07Å; W527-Q531 WeakPolarHBondContact O-CB 3.07Å; W527-Q531 PolarHBondContact O-N 2.91Å; G528-Q531 PolarHBondContact O-N 3.42Å; Q531-L534 PolarHBondContact O-N 3.27Å; Q531-Y535 PolarHBondContact O-N 3.47Å
532	Q	93.3	Very high	90.8	Very high	98 Å²	98	50 Å²	50	46%	0.458	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-45.3	175.8	-178.9	61.1	23.6	0	0	111.5	G528 L534 Y535 E536	G528-Q532 WeakPolarHBondContact O-CB 3.5Å; G528-Q532 PolarHBondContact O-N 3.22Å; Q532-L534 PolarHBondContact O-N 3.09Å; Q532-Y535 WeakPolarHBondContact O-CB 3.22Å; Q532-Y535 PolarHBondContact O-N 2.84Å; Q532-E536 WeakPolarHBondContact CG-OE1 3.41Å; Q532-E536 PolarHBondContact NE2-OE1 2.83Å; Q532-E536 WeakPolarHBondContact O-CG 3.39Å; Q532-E536 PolarHBondContact O-N 3.31Å
533	F	94.6	Very high	88.9	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.9	-47.2	174.7	170.6	-103.6	0	0	0	112.2	I424 V425 H428 L463 F464 S529 M530 Y535 E536 I537	I424-F533 HydrophobicContact CG2-CD1 4.45Å; I424-F533 HydrophobicContact CG2-CE1 3.87Å; I424-F533 HydrophobicContact CG2-CE2 4.24Å; I424-F533 HydrophobicContact CG2-CZ 3.75Å; I424-F533 VanDerWaalsContact O-CE2 3.3Å; I424-F533 WeakPolarHBondContact O-CE2 3.27Å; V425-F533 HydrophobicContact CG1-CB 4.37Å; V425-F533 HydrophobicContact CG2-CB 4.16Å; V425-F533 HydrophobicContact CG2-CG 4.46Å; H428-F533 HydrophobicContact CB-CD2 4.13Å; H428-F533 HydrophobicContact CB-CE2 4.23Å; L463-F533 HydrophobicContact CD2-CE1 3.89Å; L463-F533 HydrophobicContact CD2-CZ 4.16Å; F464-F533 HydrophobicContact CE2-CD1 4.39Å; F464-F533 HydrophobicContact CE2-CE1 4.04Å; F464-F533 HydrophobicContact CZ-CD1 4.14Å; F464-F533 AromaticContact CZ-CE1 3.76Å; F464-F533 HydrophobicContact CZ-CE1 3.76Å; S529-F533 WeakPolarHBondContact O-CB 3.44Å; S529-F533 PolarHBondContact O-N 2.81Å; M530-F533 PolarHBondContact O-N 2.66Å; M530-F533 HydrophobicContact SD-CD1 4.42Å; F533-Y535 VanDerWaalsContact C-N 3.27Å; F533-Y535 PolarHBondContact O-N 2.68Å; F533-E536 PolarHBondContact O-N 3.25Å; F533-I537 HydrophobicContact CD2-CG2 4.02Å; F533-I537 HydrophobicContact CE1-CD1 3.99Å; F533-I537 HydrophobicContact CE1-CG2 4.32Å; F533-I537 HydrophobicContact CE2-CG2 3.54Å; F533-I537 HydrophobicContact CZ-CD1 4.25Å; F533-I537 HydrophobicContact CZ-CG2 3.71Å; F533-I537 WeakPolarHBondContact O-CG1 3.46Å; F533-I537 PolarHBondContact O-N 3.33Å
534	L	93.7	Very high	87	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59	-38.9	177.5	-76.1	172.6	0	0	0	111.8	I459 F464 F506 M530 Q531 Q532 I537 S538	I459-L534 HydrophobicContact CG2-CD2 4.02Å; F464-L534 HydrophobicContact CE2-CD2 4.06Å; F506-L534 HydrophobicContact CE2-CD1 3.83Å; F506-L534 HydrophobicContact CZ-CD1 3.89Å; M530-L534 HydrophobicContact CG-CD1 4.27Å; M530-L534 WeakPolarHBondContact O-CB 3.37Å; M530-L534 WeakPolarHBondContact O-CG 3.26Å; M530-L534 PolarHBondContact O-N 3.11Å; M530-L534 HydrophobicContact SD-CD1 4.39Å; M530-L534 HydrophobicContact SD-CG 4.29Å; Q531-L534 PolarHBondContact O-N 3.27Å; Q532-L534 PolarHBondContact O-N 3.09Å; L534-I537 HydrophobicContact CD2-CD1 4.32Å; L534-I537 WeakPolarHBondContact O-CG1 3.49Å; L534-S538 PolarHBondContact O-OG 2.94Å
535	Y	91.9	Very high	85.2	Confident	110 Å²	110	59.1 Å²	59.1	43%	0.431	32%	0.315	S	S	.	.	H	α-helix	trans	-65.6	-48.7	174.2	-178.9	-96.9	0	0	0	112.1	Q531 Q532 F533 I537 S538 N539	Q531-Y535 PolarHBondContact O-N 3.47Å; Q532-Y535 WeakPolarHBondContact O-CB 3.22Å; Q532-Y535 PolarHBondContact O-N 2.84Å; F533-Y535 VanDerWaalsContact C-N 3.27Å; F533-Y535 PolarHBondContact O-N 2.68Å; Y535-I537 PolarHBondContact O-N 3.2Å; Y535-S538 CarbonylContact O-C 3.53Å; Y535-S538 PolarHBondContact O-N 3.33Å; Y535-S538 VanDerWaalsContact O-N 3.08Å; Y535-S538 PolarHBondContact O-OG 3.14Å; Y535-N539 HydrophobicContact CE1-CB 4.18Å; Y535-N539 PolarHBondContact O-N 2.83Å; Y535-N539 PolarHBondContact OH-ND2 3.11Å
536	E	92.5	Very high	83.6	Confident	39 Å²	39	55.2 Å²	55.2	18%	0.182	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-40	-178.2	-74.2	169.9	177.2	0	0	113.9	H428 K436 Q532 F533 S538 S542	H428-E536 HydrophobicContact CB-CB 4.18Å; H428-E536 IonicContact CD2-OE2 3.59Å; H428-E536 IonicContact CE1-OE2 2.95Å; H428-E536 IonicContact CG-OE2 3.38Å; H428-E536 VanDerWaalsContact CG-OE2 3.28Å; H428-E536 IonicContact ND1-OE2 3.06Å; H428-E536 PolarHBondContact ND1-OE2 3.45Å; K436-E536 WeakPolarHBondContact CE-O 3.33Å; K436-E536 PolarHBondContact NZ-O 3.42Å; Q532-E536 WeakPolarHBondContact CG-OE1 3.41Å; Q532-E536 PolarHBondContact NE2-OE1 2.83Å; Q532-E536 WeakPolarHBondContact O-CG 3.39Å; Q532-E536 PolarHBondContact O-N 3.31Å; F533-E536 PolarHBondContact O-N 3.25Å; E536-S538 PolarHBondContact O-N 3.46Å; E536-S538 VanDerWaalsContact O-N 3.13Å; E536-S542 PolarHBondContact O-OG 3.42Å
537	I	92.9	Very high	81.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-0.1	177	66.1	171.9	0	0	0	113.7	H428 F431 K436 F439 I459 L463 F533 L534 Y535	H428-I537 HydrophobicContact CB-CG2 4.21Å; F431-I537 HydrophobicContact CB-CG2 4.2Å; F431-I537 HydrophobicContact CD1-CB 3.95Å; F431-I537 HydrophobicContact CD1-CG2 4.23Å; F431-I537 HydrophobicContact CD2-CB 4.28Å; F431-I537 HydrophobicContact CD2-CG2 3.85Å; F431-I537 HydrophobicContact CE1-CB 4.06Å; F431-I537 HydrophobicContact CE2-CB 4.42Å; F431-I537 HydrophobicContact CE2-CD1 4.46Å; F431-I537 HydrophobicContact CE2-CG2 4.33Å; F431-I537 HydrophobicContact CG-CB 4.07Å; F431-I537 HydrophobicContact CG-CG2 3.83Å; F431-I537 HydrophobicContact CZ-CB 4.32Å; F431-I537 HydrophobicContact CZ-CD1 4.42Å; K436-I537 WeakPolarHBondContact CA-O 3.2Å; K436-I537 WeakPolarHBondContact CG-O 3.2Å; F439-I537 HydrophobicContact CD2-CD1 4.09Å; F439-I537 HydrophobicContact CD2-CG1 4.29Å; F439-I537 HydrophobicContact CE2-CD1 3.99Å; I459-I537 HydrophobicContact CG2-CD1 4.15Å; L463-I537 HydrophobicContact CD2-CD1 3.37Å; F533-I537 HydrophobicContact CD2-CG2 4.02Å; F533-I537 HydrophobicContact CE1-CD1 3.99Å; F533-I537 HydrophobicContact CE1-CG2 4.32Å; F533-I537 HydrophobicContact CE2-CG2 3.54Å; F533-I537 HydrophobicContact CZ-CD1 4.25Å; F533-I537 HydrophobicContact CZ-CG2 3.71Å; F533-I537 WeakPolarHBondContact O-CG1 3.46Å; F533-I537 PolarHBondContact O-N 3.33Å; L534-I537 HydrophobicContact CD2-CD1 4.32Å; L534-I537 WeakPolarHBondContact O-CG1 3.49Å; Y535-I537 PolarHBondContact O-N 3.2Å
538	S	92.1	Very high	80.6	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.014	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143.7	11.7	-172.6	62.3	0	0	0	0	114.3	A440 R443 L534 Y535 E536	A440-S538 VanDerWaalsContact CA-O 3.25Å; A440-S538 WeakPolarHBondContact CA-O 3.49Å; A440-S538 VanDerWaalsContact CB-O 3.31Å; A440-S538 WeakPolarHBondContact CB-O 3.37Å; R443-S538 VanDerWaalsContact CZ-OG 3.24Å; R443-S538 PolarHBondContact NH1-O 2.83Å; R443-S538 PolarHBondContact NH1-OG 2.97Å; R443-S538 PolarHBondContact NH2-OG 2.94Å; L534-S538 PolarHBondContact O-OG 2.94Å; Y535-S538 CarbonylContact O-C 3.53Å; Y535-S538 PolarHBondContact O-N 3.33Å; Y535-S538 VanDerWaalsContact O-N 3.08Å; Y535-S538 PolarHBondContact O-OG 3.14Å; E536-S538 PolarHBondContact O-N 3.46Å; E536-S538 VanDerWaalsContact O-N 3.13Å
539	N	87	Confident	79.8	Confident	38 Å²	38	55.2 Å²	55.2	20%	0.203	32%	0.316	C	S	.	.			trans	-111.1	119.7	161.2	-179.4	-6.2	0	0	0	109	K436 Y535 D541 S542	K436-N539 WeakPolarHBondContact CE-O 3.26Å; Y535-N539 HydrophobicContact CE1-CB 4.18Å; Y535-N539 PolarHBondContact O-N 2.83Å; Y535-N539 PolarHBondContact OH-ND2 3.11Å; N539-D541 VanDerWaalsContact C-N 3.27Å; N539-D541 PolarHBondContact O-N 3.14Å; N539-D541 PolarHBondContact OD1-N 3.22Å; N539-D541 PolarHBondContact OD1-OD2 3.38Å; N539-S542 PolarHBondContact O-N 3.35Å; N539-S542 PolarHBondContact O-OG 2.7Å
540	L	80.3	Confident	78.3	Confident	78 Å²	78	59.2 Å²	59.2	41%	0.408	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-21.6	-176	-74.2	165.6	0	0	0	114.4	K436 E437 A440 S542	K436-L540 HydrophobicContact CG-CD2 4.14Å; E437-L540 HydrophobicContact CB-CD2 4.42Å; E437-L540 HydrophobicContact CG-CD1 4.31Å; E437-L540 HydrophobicContact CG-CD2 3.57Å; A440-L540 HydrophobicContact CB-CD1 3.87Å; A440-L540 HydrophobicContact CB-CG 3.8Å; L540-S542 PolarHBondContact O-N 2.94Å
541	D	71.2	Confident	77.2	Confident	151 Å²	151	61.2 Å²	61.2	81%	0.807	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-13.7	-179.5	-60.3	-34.7	0	0	0	113.1	N539	N539-D541 VanDerWaalsContact C-N 3.27Å; N539-D541 PolarHBondContact O-N 3.14Å; N539-D541 PolarHBondContact OD1-N 3.22Å; N539-D541 PolarHBondContact OD1-OD2 3.38Å
542	S	63.3	Low	76.4	Confident	32 Å²	32	60.9 Å²	60.9	22%	0.224	35%	0.345	C	S	.	.	S	Bend	trans	-85.7	130.1	179.7	61.8	0	0	0	0	112.3	K436 E536 N539 L540 S544	K436-S542 WeakPolarHBondContact CE-OG 3.33Å; K436-S542 PolarHBondContact NZ-O 3.09Å; K436-S542 PolarHBondContact NZ-OG 3.17Å; E536-S542 PolarHBondContact O-OG 3.42Å; N539-S542 PolarHBondContact O-N 3.35Å; N539-S542 PolarHBondContact O-OG 2.7Å; L540-S542 PolarHBondContact O-N 2.94Å; S542-S544 PolarHBondContact O-N 3.14Å; S542-S544 PolarHBondContact O-OG 3.09Å
543	V	56.6	Low	76.1	Confident	110 Å²	110	57.2 Å²	57.2	67%	0.667	33%	0.329	S	S	*	.			trans	-49.6	121.9	-169.9	-177	0	0	0	0	112
544	S	57.9	Low	75.7	Confident	37 Å²	37	58 Å²	58	26%	0.259	33%	0.332	S	S	.	.			trans	-127	104.6	-176.5	-55.7	0	0	0	0	109.1	K436 S542 A546	K436-S544 WeakPolarHBondContact CD-OG 3.42Å; K436-S544 WeakPolarHBondContact CE-OG 3.31Å; K436-S544 PolarHBondContact NZ-OG 2.65Å; S542-S544 PolarHBondContact O-N 3.14Å; S542-S544 PolarHBondContact O-OG 3.09Å; S544-A546 VanDerWaalsContact C-N 3.28Å
545	N	56.9	Low	75.5	Confident	133 Å²	133	59.8 Å²	59.8	71%	0.711	34%	0.342	S	S	*	.			trans	-87	1.5	-177.7	-69.6	-34.2	0	0	0	113	C429 G547	C429-N545 PolarHBondContact O-N 2.84Å; N545-G547 PolarHBondContact O-N 3.18Å
546	A	62.5	Low	75.5	Confident	23 Å²	23	54.6 Å²	54.6	19%	0.19	32%	0.322	C	S	.	.			trans	-70	118.9	174.1	0	0	0	0	0	110.7	F431 S544	F431-A546 WeakPolarHBondContact O-CB 3.03Å; S544-A546 VanDerWaalsContact C-N 3.28Å
547	G	60.5	Low	75.4	Confident	59 Å²	59	54.6 Å²	54.6	61%	0.608	32%	0.32	S	S	*	.			trans	-61.6	158.5	160.9	0	0	0	0	0	110.9	N545	N545-G547 PolarHBondContact O-N 3.18Å
548	G	68.3	Low	75.5	Confident	40 Å²	40	55.5 Å²	55.5	41%	0.412	32%	0.324	S	S	.	.	S	Bend	trans	-66.7	174	177.9	0	0	0	0	0	113.4	E434 E550	E434-G548 WeakPolarHBondContact OE1-CA 3.25Å; G548-E550 WeakPolarHBondContact O-CG 3.15Å; G548-E550 PolarHBondContact O-N 2.99Å
549	F	76.3	Confident	75.7	Confident	57 Å²	57	55.4 Å²	55.4	25%	0.25	32%	0.324	C	S	.	.			trans	-49.7	104.1	-174.4	178.8	-106.8	0	0	0	113.5	Q326 L370 I371 E434 G551 I553	Q326-F549 HydrophobicContact CG-CD1 4.4Å; Q326-F549 HydrophobicContact CG-CE1 4.46Å; L370-F549 HydrophobicContact CD1-CE2 3.84Å; L370-F549 HydrophobicContact CD1-CZ 3.7Å; L370-F549 HydrophobicContact CG-CE2 4.05Å; L370-F549 HydrophobicContact CG-CZ 4.2Å; I371-F549 HydrophobicContact CD1-CB 4.23Å; I371-F549 HydrophobicContact CD1-CD2 3.44Å; I371-F549 VanDerWaalsContact CD1-CD2 3.44Å; I371-F549 HydrophobicContact CD1-CE2 3.95Å; I371-F549 HydrophobicContact CD1-CG 3.92Å; E434-F549 PolarHBondContact OE1-N 3.08Å; F549-G551 VanDerWaalsContact C-N 3.27Å; F549-G551 WeakPolarHBondContact CE1-O 3.38Å; F549-G551 PolarHBondContact O-N 3.22Å; F549-I553 HydrophobicContact CE1-CD1 3.84Å; F549-I553 HydrophobicContact CE1-CG1 3.96Å; F549-I553 HydrophobicContact CZ-CD1 4.11Å; F549-I553 HydrophobicContact CZ-CG1 4.12Å
550	E	65.5	Low	76	Confident	127 Å²	127	54 Å²	54	59%	0.593	32%	0.317	S	S	*	.			trans	-82.5	0.4	-179	-56.5	-177.8	117.5	0	0	113.8	K374 G548	K374-E550 IonicContact NZ-OE2 2.79Å; K374-E550 PolarHBondContact NZ-OE2 3.45Å; G548-E550 WeakPolarHBondContact O-CG 3.15Å; G548-E550 PolarHBondContact O-N 2.99Å
551	G	70.7	Confident	76.7	Confident	41 Å²	41	52.1 Å²	52.1	42%	0.423	31%	0.307	S	S	.	.			trans	-81.2	156.4	-176	0	0	0	0	0	113.6	F549	F549-G551 VanDerWaalsContact C-N 3.27Å; F549-G551 WeakPolarHBondContact CE1-O 3.38Å; F549-G551 PolarHBondContact O-N 3.22Å
552	Y	76.8	Confident	77.9	Confident	103 Å²	103	45 Å²	45	40%	0.404	27%	0.269	S	S	.	.			trans	-97.8	142.7	169.9	173.9	-113.3	0	0	0	111	E130 D554	E130-Y552 HydrophobicContact CG-CD1 3.8Å; E130-Y552 HydrophobicContact CG-CD2 4.46Å; E130-Y552 HydrophobicContact CG-CE1 3.95Å; E130-Y552 HydrophobicContact CG-CG 4.06Å; E130-Y552 WeakPolarHBondContact OE1-CD2 3.48Å; E130-Y552 WeakPolarHBondContact OE1-CE2 3.25Å; E130-Y552 WeakPolarHBondContact OE2-CB 3.41Å; E130-Y552 WeakPolarHBondContact OE2-CD2 3.26Å; Y552-D554 HydrophobicContact CE1-CB 3.92Å
553	I	85.8	Confident	79.4	Confident	22 Å²	22	43.7 Å²	43.7	11%	0.113	26%	0.259	C	S	.	.			trans	-125.7	119.1	173.7	-61.3	174.9	0	0	0	107.6	H323 Q326 L370 F549 L555 E558	H323-I553 HydrophobicContact CB-CG2 3.98Å; Q326-I553 HydrophobicContact CB-CD1 3.95Å; Q326-I553 HydrophobicContact CG-CD1 3.77Å; L370-I553 HydrophobicContact CD2-CD1 4.16Å; F549-I553 HydrophobicContact CE1-CD1 3.84Å; F549-I553 HydrophobicContact CE1-CG1 3.96Å; F549-I553 HydrophobicContact CZ-CD1 4.11Å; F549-I553 HydrophobicContact CZ-CG1 4.12Å; I553-L555 VanDerWaalsContact C-N 3.34Å; I553-L555 PolarHBondContact O-N 2.66Å; I553-E558 HydrophobicContact CG2-CG 4.24Å
554	D	86.6	Confident	81.2	Confident	15 Å²	15	41.8 Å²	41.8	8%	0.08	25%	0.251	C	S	.	.			trans	-75	88.6	171.9	-173.4	-37.2	0	0	0	109.1	R145 Y552 G556 R557 E558	R145-D554 IonicContact CZ-OD1 3.56Å; R145-D554 IonicContact CZ-OD2 3.06Å; R145-D554 IonicContact NE-OD2 2.97Å; R145-D554 IonicContact NH2-OD1 2.74Å; R145-D554 PolarHBondContact NH2-OD1 3.04Å; R145-D554 IonicContact NH2-OD2 2.81Å; R145-D554 PolarHBondContact NH2-OD2 3.06Å; Y552-D554 HydrophobicContact CE1-CB 3.92Å; D554-G556 PolarHBondContact O-N 2.93Å; D554-G556 PolarHBondContact OD1-N 3.39Å; D554-R557 HydrophobicContact CB-CB 3.91Å; D554-R557 WeakPolarHBondContact O-CB 3.49Å; D554-R557 PolarHBondContact O-N 3.25Å; D554-R557 WeakPolarHBondContact OD1-CB 3.45Å; D554-R557 PolarHBondContact OD1-N 3.22Å; D554-E558 PolarHBondContact O-N 2.92Å
555	L	90.4	Very high	82.8	Confident	38 Å²	38	40.5 Å²	40.5	20%	0.199	24%	0.241	C	C	.	.	H	α-helix	trans	-59.7	-31.1	-178	179.1	54.4	0	0	0	112.7	M284 I324 S327 I553 E558 L559	M284-L555 HydrophobicContact CE-CB 3.96Å; M284-L555 HydrophobicContact CE-CD2 4.27Å; M284-L555 HydrophobicContact CE-CG 3.91Å; M284-L555 HydrophobicContact SD-CD2 4.42Å; M284-L555 HydrophobicContact SD-CG 4.41Å; I324-L555 HydrophobicContact CB-CD1 4.31Å; I324-L555 HydrophobicContact CG1-CD1 3.97Å; I324-L555 HydrophobicContact CG2-CD1 4.18Å; S327-L555 WeakPolarHBondContact OG-CD1 3.37Å; I553-L555 VanDerWaalsContact C-N 3.34Å; I553-L555 PolarHBondContact O-N 2.66Å; L555-E558 PolarHBondContact O-N 2.85Å; L555-L559 HydrophobicContact CD1-CD1 3.58Å; L555-L559 HydrophobicContact CD1-CD2 4.49Å; L555-L559 HydrophobicContact CD1-CG 3.76Å; L555-L559 HydrophobicContact CD2-CD1 4.4Å; L555-L559 HydrophobicContact CG-CD1 3.63Å; L555-L559 HydrophobicContact CG-CG 4.31Å; L555-L559 WeakPolarHBondContact O-CB 3.41Å; L555-L559 WeakPolarHBondContact O-CD1 3.48Å; L555-L559 VanDerWaalsContact O-CG 3.24Å; L555-L559 WeakPolarHBondContact O-CG 3.49Å; L555-L559 PolarHBondContact O-N 3.38Å
556	G	91.6	Very high	84.7	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-42	177.9	0	0	0	0	0	112	D554 S560	D554-G556 PolarHBondContact O-N 2.93Å; D554-G556 PolarHBondContact OD1-N 3.39Å; G556-S560 WeakPolarHBondContact O-CB 3.49Å; G556-S560 PolarHBondContact O-N 3.05Å
557	R	90.9	Very high	86.2	Confident	40 Å²	40	38 Å²	38	15%	0.151	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-51.4	171.8	171.3	-175.8	157.6	135.8	-11.8	111.4	D147 N198 M279 I281 D554 L559 S560 I561	D147-R557 WeakPolarHBondContact OD2-CD 3.39Å; D147-R557 IonicContact OD2-CZ 3.79Å; D147-R557 IonicContact OD2-NE 3.35Å; D147-R557 IonicContact OD2-NH1 3.23Å; D147-R557 PolarHBondContact OD2-NH1 3.04Å; N198-R557 PolarHBondContact OD1-NH1 3.31Å; N198-R557 PolarHBondContact OD1-NH2 2.99Å; M279-R557 HydrophobicContact CE-CG 3.91Å; I281-R557 HydrophobicContact CD1-CB 3.74Å; I281-R557 HydrophobicContact CD1-CG 4.46Å; D554-R557 HydrophobicContact CB-CB 3.91Å; D554-R557 WeakPolarHBondContact O-CB 3.49Å; D554-R557 PolarHBondContact O-N 3.25Å; D554-R557 WeakPolarHBondContact OD1-CB 3.45Å; D554-R557 PolarHBondContact OD1-N 3.22Å; R557-L559 PolarHBondContact O-N 3.43Å; R557-S560 CarbonylContact O-C 3.49Å; R557-S560 WeakPolarHBondContact O-CA 3.48Å; R557-S560 WeakPolarHBondContact O-CB 3.26Å; R557-S560 PolarHBondContact O-N 3.17Å; R557-S560 VanDerWaalsContact O-N 3.07Å; R557-I561 HydrophobicContact CG-CD1 3.88Å; R557-I561 WeakPolarHBondContact O-CG1 3.17Å; R557-I561 PolarHBondContact O-N 2.8Å
558	E	94.4	Very high	87.6	Confident	18 Å²	18	39.7 Å²	39.7	8%	0.084	21%	0.209	C	C	.	.	H	α-helix	trans	-68.2	-34.9	-175.1	-61.4	-53.5	130.4	0	0	112.4	H323 I324 I553 D554 L555 I561 L562	H323-E558 HydrophobicContact CB-CB 4.41Å; H323-E558 HydrophobicContact CB-CG 3.87Å; I324-E558 HydrophobicContact CD1-CB 4.49Å; I324-E558 HydrophobicContact CG1-CB 3.96Å; I553-E558 HydrophobicContact CG2-CG 4.24Å; D554-E558 PolarHBondContact O-N 2.92Å; L555-E558 PolarHBondContact O-N 2.85Å; E558-I561 PolarHBondContact O-N 2.81Å; E558-L562 WeakPolarHBondContact O-CB 3.24Å; E558-L562 PolarHBondContact O-N 2.84Å
559	L	95.6	Very high	88.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-37.2	169.3	-71	162.6	0	0	0	112	M284 Y287 F290 A291 I324 L555 R557 H563	M284-L559 HydrophobicContact SD-CD1 4.08Å; Y287-L559 HydrophobicContact CD1-CB 4.01Å; Y287-L559 HydrophobicContact CE1-CB 4.5Å; Y287-L559 HydrophobicContact CG-CB 4.05Å; Y287-L559 HydrophobicContact CG-CD1 4.42Å; F290-L559 HydrophobicContact CD1-CB 4.42Å; F290-L559 HydrophobicContact CD1-CD2 3.74Å; F290-L559 HydrophobicContact CE1-CB 4.34Å; F290-L559 HydrophobicContact CE1-CD2 3.81Å; F290-L559 WeakPolarHBondContact CE1-O 3.19Å; A291-L559 HydrophobicContact CB-CD1 3.81Å; A291-L559 HydrophobicContact CB-CD2 3.86Å; I324-L559 HydrophobicContact CD1-CD2 3.81Å; I324-L559 HydrophobicContact CD1-CG 4.23Å; I324-L559 HydrophobicContact CG1-CD2 4.15Å; I324-L559 HydrophobicContact CG1-CG 4.26Å; I324-L559 HydrophobicContact CG2-CD2 4.29Å; L555-L559 HydrophobicContact CD1-CD1 3.58Å; L555-L559 HydrophobicContact CD1-CD2 4.49Å; L555-L559 HydrophobicContact CD1-CG 3.76Å; L555-L559 HydrophobicContact CD2-CD1 4.4Å; L555-L559 HydrophobicContact CG-CD1 3.63Å; L555-L559 HydrophobicContact CG-CG 4.31Å; L555-L559 WeakPolarHBondContact O-CB 3.41Å; L555-L559 WeakPolarHBondContact O-CD1 3.48Å; L555-L559 VanDerWaalsContact O-CG 3.24Å; L555-L559 WeakPolarHBondContact O-CG 3.49Å; L555-L559 PolarHBondContact O-N 3.38Å; R557-L559 PolarHBondContact O-N 3.43Å; L559-H563 WeakPolarHBondContact O-CB 3.4Å; L559-H563 PolarHBondContact O-N 3.13Å
560	S	94.4	Very high	89.5	Confident	10 Å²	10	36.7 Å²	36.7	7%	0.07	19%	0.186	C	C	.	.	H	α-helix	trans	-67.1	-34.3	173.3	-167.5	0	0	0	0	113	N280 Y287 G556 R557 S564	N280-S560 PolarHBondContact O-OG 2.94Å; Y287-S560 WeakPolarHBondContact OH-CB 3.48Å; Y287-S560 PolarHBondContact OH-OG 3.28Å; G556-S560 WeakPolarHBondContact O-CB 3.49Å; G556-S560 PolarHBondContact O-N 3.05Å; R557-S560 CarbonylContact O-C 3.49Å; R557-S560 WeakPolarHBondContact O-CA 3.48Å; R557-S560 WeakPolarHBondContact O-CB 3.26Å; R557-S560 PolarHBondContact O-N 3.17Å; R557-S560 VanDerWaalsContact O-N 3.07Å; S560-S564 PolarHBondContact O-N 3.39Å
561	I	93.7	Very high	90.6	Very high	38 Å²	38	35.2 Å²	35.2	20%	0.195	20%	0.195	C	C	.	.	H	α-helix	trans	-67.3	-54.4	173.9	-70.1	166.1	0	0	0	109.3	M279 A320 R557 E558 H563 S564 L565	M279-I561 HydrophobicContact CE-CD1 4.2Å; M279-I561 HydrophobicContact CE-CG1 4.28Å; M279-I561 HydrophobicContact SD-CD1 4.13Å; M279-I561 HydrophobicContact SD-CG1 3.61Å; A320-I561 HydrophobicContact CB-CG2 4.05Å; R557-I561 HydrophobicContact CG-CD1 3.88Å; R557-I561 WeakPolarHBondContact O-CG1 3.17Å; R557-I561 PolarHBondContact O-N 2.8Å; E558-I561 PolarHBondContact O-N 2.81Å; I561-H563 VanDerWaalsContact C-N 3.29Å; I561-H563 PolarHBondContact O-N 3.28Å; I561-S564 PolarHBondContact O-N 2.94Å; I561-S564 VanDerWaalsContact O-N 3.09Å; I561-L565 HydrophobicContact CG2-CD1 3.78Å; I561-L565 HydrophobicContact CG2-CG 4.28Å; I561-L565 VanDerWaalsContact O-CG 3.32Å; I561-L565 WeakPolarHBondContact O-CG 3.23Å; I561-L565 PolarHBondContact O-N 3.24Å
562	L	96.3	Very high	91.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-38.2	-179.1	-172.8	64.7	0	0	0	112	F290 V294 V317 A320 L321 I324 E558 L565 L566	F290-L562 HydrophobicContact CE1-CB 4.5Å; F290-L562 HydrophobicContact CZ-CB 4.23Å; F290-L562 HydrophobicContact CZ-CD2 3.93Å; F290-L562 HydrophobicContact CZ-CG 3.97Å; V294-L562 HydrophobicContact CG1-CD2 4.06Å; V294-L562 HydrophobicContact CG2-CD2 3.79Å; V317-L562 HydrophobicContact CG1-CD1 4.26Å; A320-L562 HydrophobicContact CB-CB 4Å; A320-L562 HydrophobicContact CB-CD1 4.33Å; L321-L562 HydrophobicContact CD2-CD1 4.32Å; L321-L562 HydrophobicContact CD2-CD2 3.72Å; L321-L562 HydrophobicContact CG-CD1 4.2Å; L321-L562 HydrophobicContact CG-CD2 4.39Å; I324-L562 HydrophobicContact CD1-CB 3.84Å; I324-L562 HydrophobicContact CD1-CD2 3.53Å; I324-L562 HydrophobicContact CD1-CG 4.32Å; E558-L562 WeakPolarHBondContact O-CB 3.24Å; E558-L562 PolarHBondContact O-N 2.84Å; L562-L565 PolarHBondContact O-N 3.2Å; L562-L566 HydrophobicContact CD1-CD1 4.17Å; L562-L566 HydrophobicContact CD1-CD2 4.48Å; L562-L566 HydrophobicContact CD1-CG 4.06Å; L562-L566 HydrophobicContact CD2-CD1 4.34Å; L562-L566 HydrophobicContact CG-CD1 3.85Å; L562-L566 HydrophobicContact CG-CG 4.16Å; L562-L566 WeakPolarHBondContact O-CB 3.21Å; L562-L566 VanDerWaalsContact O-CG 3.25Å; L562-L566 WeakPolarHBondContact O-CG 3.27Å; L562-L566 PolarHBondContact O-N 3.03Å
563	H	95.9	Very high	92.4	Very high	6 Å²	6	34.6 Å²	34.6	3%	0.028	19%	0.186	C	C	.	.	H	α-helix	trans	-55.6	-52.1	171.8	170.1	-89.1	0	0	0	111.7	F290 L559 I561 L565 L566 W567 L588 I591 S592	F290-H563 HydrophobicContact CE1-CB 4.18Å; L559-H563 WeakPolarHBondContact O-CB 3.4Å; L559-H563 PolarHBondContact O-N 3.13Å; I561-H563 VanDerWaalsContact C-N 3.29Å; I561-H563 PolarHBondContact O-N 3.28Å; H563-L565 VanDerWaalsContact C-N 3.31Å; H563-L565 PolarHBondContact O-N 2.99Å; H563-L566 PolarHBondContact O-N 2.62Å; H563-W567 VanDerWaalsContact O-CB 3.27Å; H563-W567 WeakPolarHBondContact O-CB 3.38Å; H563-W567 PolarHBondContact O-N 3.35Å; H563-L588 HydrophobicContact CB-CD2 4.45Å; H563-L588 PolarHBondContact NE2-O 3.32Å; H563-I591 HydrophobicContact CB-CG2 4.43Å; H563-I591 WeakPolarHBondContact CD2-CG2 2.94Å; H563-I591 WeakPolarHBondContact NE2-CG2 3.12Å; H563-S592 PolarHBondContact CE1-OG 2.6Å; H563-S592 PolarHBondContact NE2-OG 2.86Å; H563-S592 VanDerWaalsContact NE2-OG 3.11Å
564	S	93.3	Very high	92.8	Very high	70 Å²	70	36.9 Å²	36.9	49%	0.49	20%	0.203	S	C	.	.	H	α-helix	trans	-63.9	-35.8	-179.5	-173	0	0	0	0	112.7	S560 I561 E568	S560-S564 PolarHBondContact O-N 3.39Å; I561-S564 PolarHBondContact O-N 2.94Å; I561-S564 VanDerWaalsContact O-N 3.09Å; S564-E568 PolarHBondContact O-N 2.79Å
565	L	93.5	Very high	93	Very high	9 Å²	9	44.5 Å²	44.5	5%	0.047	24%	0.236	C	C	.	.	H	α-helix	trans	-68.1	-48	176.9	-67.6	172.4	0	0	0	111.4	E316 V317 I561 L562 H563 V569	E316-L565 HydrophobicContact CB-CD1 4.03Å; E316-L565 HydrophobicContact CB-CD2 3.95Å; E316-L565 WeakPolarHBondContact O-CD1 3.32Å; V317-L565 HydrophobicContact CG2-CB 3.99Å; V317-L565 HydrophobicContact CG2-CD1 3.97Å; V317-L565 HydrophobicContact CG2-CG 4.47Å; I561-L565 HydrophobicContact CG2-CD1 3.78Å; I561-L565 HydrophobicContact CG2-CG 4.28Å; I561-L565 VanDerWaalsContact O-CG 3.32Å; I561-L565 WeakPolarHBondContact O-CG 3.23Å; I561-L565 PolarHBondContact O-N 3.24Å; L562-L565 PolarHBondContact O-N 3.2Å; H563-L565 VanDerWaalsContact C-N 3.31Å; H563-L565 PolarHBondContact O-N 2.99Å; L565-V569 WeakPolarHBondContact O-CG2 3.27Å; L565-V569 PolarHBondContact O-N 3.04Å
566	L	95.2	Very high	93.1	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-40.6	179.7	-66.5	176.4	0	0	0	111.3	F290 L301 L305 L562 H563 E568 V569 M570 L584 L588	F290-L566 HydrophobicContact CE2-CD1 3.86Å; F290-L566 HydrophobicContact CZ-CD1 3.96Å; L301-L566 HydrophobicContact CD1-CD1 4.46Å; L301-L566 HydrophobicContact CD1-CD2 4.14Å; L305-L566 HydrophobicContact CD1-CD2 3.56Å; L305-L566 HydrophobicContact CD2-CD2 4.17Å; L305-L566 HydrophobicContact CG-CD2 4.5Å; L562-L566 HydrophobicContact CD1-CD1 4.17Å; L562-L566 HydrophobicContact CD1-CD2 4.48Å; L562-L566 HydrophobicContact CD1-CG 4.06Å; L562-L566 HydrophobicContact CD2-CD1 4.34Å; L562-L566 HydrophobicContact CG-CD1 3.85Å; L562-L566 HydrophobicContact CG-CG 4.16Å; L562-L566 WeakPolarHBondContact O-CB 3.21Å; L562-L566 VanDerWaalsContact O-CG 3.25Å; L562-L566 WeakPolarHBondContact O-CG 3.27Å; L562-L566 PolarHBondContact O-N 3.03Å; H563-L566 PolarHBondContact O-N 2.62Å; L566-E568 VanDerWaalsContact C-N 3.31Å; L566-E568 PolarHBondContact O-N 3.31Å; L566-V569 CarbonylContact O-C 3.39Å; L566-V569 PolarHBondContact O-N 2.74Å; L566-M570 VanDerWaalsContact O-CG 3.31Å; L566-M570 WeakPolarHBondContact O-CG 3.42Å; L566-M570 PolarHBondContact O-N 3.2Å; L566-L584 HydrophobicContact CD1-CD1 4.33Å; L566-L584 HydrophobicContact CD1-CD2 4.41Å; L566-L588 HydrophobicContact CB-CD1 3.72Å; L566-L588 HydrophobicContact CB-CD2 4.14Å; L566-L588 HydrophobicContact CD1-CD2 4.31Å
567	W	93.6	Very high	93.1	Very high	101 Å²	101	48.4 Å²	48.4	38%	0.383	26%	0.259	S	S	.	.	H	α-helix	trans	-58.8	-38.2	179.7	-174.4	-102.7	0	0	0	113.2	H563 V569 L588 N589 S592	H563-W567 VanDerWaalsContact O-CB 3.27Å; H563-W567 WeakPolarHBondContact O-CB 3.38Å; H563-W567 PolarHBondContact O-N 3.35Å; W567-V569 VanDerWaalsContact C-N 3.35Å; W567-L588 HydrophobicContact CE3-CB 3.89Å; W567-L588 HydrophobicContact CZ3-CB 4.29Å; W567-N589 HydrophobicContact CH2-CB 4.21Å; W567-N589 HydrophobicContact CZ3-CB 4Å; W567-S592 VanDerWaalsContact CD2-OG 3.29Å
568	E	90.9	Very high	93.1	Very high	94 Å²	94	49.1 Å²	49.1	44%	0.439	27%	0.265	S	S	.	.	H	α-helix	trans	-68.8	-32.5	175	-166.7	-172.5	100.6	0	0	112.7	R239 S564 L566 Q572	R239-E568 IonicContact CZ-OE1 2.74Å; R239-E568 IonicContact CZ-OE2 2.78Å; R239-E568 IonicContact NH1-OE1 3.21Å; R239-E568 PolarHBondContact NH1-OE1 3.31Å; R239-E568 IonicContact NH1-OE2 3.06Å; R239-E568 PolarHBondContact NH1-OE2 2.85Å; S564-E568 PolarHBondContact O-N 2.79Å; L566-E568 VanDerWaalsContact C-N 3.31Å; L566-E568 PolarHBondContact O-N 3.31Å; E568-Q572 PolarHBondContact O-NE2 3.2Å; E568-Q572 VanDerWaalsContact O-NE2 3.12Å
569	V	92.9	Very high	93.1	Very high	8 Å²	8	54.3 Å²	54.3	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-86.2	-28.4	-177.8	177.8	0	0	0	0	112.3	L305 V308 L309 L565 L566 W567 A571 Q572 L573	L305-V569 HydrophobicContact CD2-CG1 3.74Å; V308-V569 HydrophobicContact CG1-CG1 4.28Å; L309-V569 HydrophobicContact CD2-CB 4.44Å; L309-V569 HydrophobicContact CD2-CG1 4.04Å; L309-V569 HydrophobicContact CD2-CG2 3.62Å; L565-V569 WeakPolarHBondContact O-CG2 3.27Å; L565-V569 PolarHBondContact O-N 3.04Å; L566-V569 CarbonylContact O-C 3.39Å; L566-V569 PolarHBondContact O-N 2.74Å; W567-V569 VanDerWaalsContact C-N 3.35Å; V569-A571 PolarHBondContact O-N 2.81Å; V569-A571 VanDerWaalsContact O-N 3.1Å; V569-Q572 WeakPolarHBondContact O-CA 3.44Å; V569-Q572 WeakPolarHBondContact O-CB 3.3Å; V569-Q572 PolarHBondContact O-N 2.97Å; V569-L573 HydrophobicContact CG1-CD2 4.26Å
570	M	91.5	Very high	93	Very high	27 Å²	27	61.1 Å²	61.1	13%	0.133	32%	0.321	C	S	.	.	H	α-helix	trans	-53.1	-34.5	179.2	-80.6	-52.4	-51.9	0	0	113.1	L566 Q572 L573 I578 L581 P585 L588	L566-M570 VanDerWaalsContact O-CG 3.31Å; L566-M570 WeakPolarHBondContact O-CG 3.42Å; L566-M570 PolarHBondContact O-N 3.2Å; M570-Q572 PolarHBondContact O-N 3.2Å; M570-L573 HydrophobicContact CE-CD1 4.08Å; M570-L573 HydrophobicContact SD-CD1 3.8Å; M570-I578 HydrophobicContact CE-CD1 4.39Å; M570-I578 HydrophobicContact CE-CG1 3.85Å; M570-I578 HydrophobicContact CE-CG2 4.16Å; M570-L581 HydrophobicContact SD-CD1 4.23Å; M570-P585 HydrophobicContact CE-CB 4.03Å; M570-P585 HydrophobicContact CE-CG 3.78Å; M570-L588 HydrophobicContact CG-CD1 3.61Å; M570-L588 HydrophobicContact SD-CD1 4.02Å
571	A	89.8	Confident	92.9	Very high	95 Å²	95	60.7 Å²	60.7	79%	0.785	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-12.3	178	0	0	0	0	0	114.3	V569	V569-A571 PolarHBondContact O-N 2.81Å; V569-A571 VanDerWaalsContact O-N 3.1Å
572	Q	92	Very high	93	Very high	116 Å²	116	61.1 Å²	61.1	54%	0.542	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-7.4	-176.8	-54.7	172.6	44.5	0	0	112.2	V308 E568 V569 M570	V308-Q572 HydrophobicContact CG1-CB 4.01Å; E568-Q572 PolarHBondContact O-NE2 3.2Å; E568-Q572 VanDerWaalsContact O-NE2 3.12Å; V569-Q572 WeakPolarHBondContact O-CA 3.44Å; V569-Q572 WeakPolarHBondContact O-CB 3.3Å; V569-Q572 PolarHBondContact O-N 2.97Å; M570-Q572 PolarHBondContact O-N 3.2Å
573	L	92.6	Very high	92.9	Very high	16 Å²	16	64.4 Å²	64.4	8%	0.084	35%	0.354	C	S	.	.	S	Bend	trans	-81.8	144.9	-178.2	-60.4	-175.7	0	0	0	112.1	V304 V308 V569 M570 A577 I578 L581	V304-L573 HydrophobicContact CG1-CD1 4.39Å; V304-L573 HydrophobicContact CG1-CD2 4.37Å; V308-L573 HydrophobicContact CB-CD2 4.28Å; V308-L573 HydrophobicContact CG1-CD2 4.23Å; V308-L573 HydrophobicContact CG2-CD2 3.94Å; V569-L573 HydrophobicContact CG1-CD2 4.26Å; M570-L573 HydrophobicContact CE-CD1 4.08Å; M570-L573 HydrophobicContact SD-CD1 3.8Å; L573-A577 HydrophobicContact CB-CB 4.1Å; L573-I578 HydrophobicContact CB-CD1 4.24Å; L573-I578 HydrophobicContact CB-CG1 3.72Å; L573-I578 HydrophobicContact CD1-CG1 4.38Å; L573-L581 HydrophobicContact CD1-CD1 3.43Å; L573-L581 VanDerWaalsContact CD1-CD1 3.43Å
574	S	93.2	Very high	92.9	Very high	69 Å²	69	64.1 Å²	64.1	48%	0.483	35%	0.352	S	S	.	.			trans	-68.5	159.8	169.8	72.2	0	0	0	0	111.6	D576 A577 I578	S574-D576 PolarHBondContact O-N 3.04Å; S574-A577 WeakPolarHBondContact O-CB 3.4Å; S574-A577 PolarHBondContact O-N 3.35Å; S574-A577 VanDerWaalsContact O-N 3.1Å; S574-A577 WeakPolarHBondContact OG-CB 3.25Å; S574-A577 PolarHBondContact OG-N 3.11Å; S574-I578 WeakPolarHBondContact O-CG1 3.24Å; S574-I578 PolarHBondContact O-N 3.49Å
575	K	91.3	Very high	93	Very high	175 Å²	175	62.7 Å²	62.7	76%	0.761	34%	0.341	S	S	*	.	H	α-helix	trans	-55.7	-40.7	177.9	-66	-178.4	-179	178.8	0	112	I578 I579	K575-I578 PolarHBondContact O-N 2.91Å; K575-I579 VanDerWaalsContact O-CG1 3.28Å; K575-I579 WeakPolarHBondContact O-CG1 3.33Å; K575-I579 PolarHBondContact O-N 2.91Å
576	D	91.9	Very high	93.1	Very high	108 Å²	108	67.6 Å²	67.6	58%	0.578	36%	0.359	S	S	*	.	H	α-helix	trans	-70	-34.4	179.6	-45.7	-42.8	0	0	0	112.3	S574 I579 K580	S574-D576 PolarHBondContact O-N 3.04Å; D576-I579 PolarHBondContact O-N 3.14Å; D576-K580 VanDerWaalsContact O-CG 3.27Å; D576-K580 WeakPolarHBondContact O-CG 3.17Å; D576-K580 PolarHBondContact O-N 3.12Å
577	A	91.8	Very high	93.2	Very high	14 Å²	14	67.9 Å²	67.9	12%	0.116	36%	0.36	C	S	.	.	H	α-helix	trans	-64.5	-43.2	171.4	0	0	0	0	0	111.3	V304 L573 S574 K580 L581	V304-A577 HydrophobicContact CG1-CB 3.71Å; L573-A577 HydrophobicContact CB-CB 4.1Å; S574-A577 WeakPolarHBondContact O-CB 3.4Å; S574-A577 PolarHBondContact O-N 3.35Å; S574-A577 VanDerWaalsContact O-N 3.1Å; S574-A577 WeakPolarHBondContact OG-CB 3.25Å; S574-A577 PolarHBondContact OG-N 3.11Å; A577-K580 PolarHBondContact O-N 3.47Å; A577-L581 WeakPolarHBondContact O-CG 3.46Å; A577-L581 PolarHBondContact O-N 2.89Å
578	I	92.1	Very high	93.3	Very high	55 Å²	55	63 Å²	63	28%	0.282	34%	0.342	S	S	.	.	H	α-helix	trans	-63.3	-42.6	176.2	-64.1	171.3	0	0	0	110.8	M570 L573 S574 K575 L581 P585	M570-I578 HydrophobicContact CE-CD1 4.39Å; M570-I578 HydrophobicContact CE-CG1 3.85Å; M570-I578 HydrophobicContact CE-CG2 4.16Å; L573-I578 HydrophobicContact CB-CD1 4.24Å; L573-I578 HydrophobicContact CB-CG1 3.72Å; L573-I578 HydrophobicContact CD1-CG1 4.38Å; S574-I578 WeakPolarHBondContact O-CG1 3.24Å; S574-I578 PolarHBondContact O-N 3.49Å; K575-I578 PolarHBondContact O-N 2.91Å; I578-L581 PolarHBondContact O-N 3.19Å; I578-L581 VanDerWaalsContact O-N 3.17Å; I578-P585 HydrophobicContact CG2-CB 4.45Å; I578-P585 HydrophobicContact CG2-CG 3.71Å
579	I	92.9	Very high	93.5	Very high	127 Å²	127	61.2 Å²	61.2	65%	0.651	34%	0.335	S	S	*	.	H	α-helix	trans	-62.2	-43	176.5	-69.7	162.5	0	0	0	111.3	K575 D576 L581 G582	K575-I579 VanDerWaalsContact O-CG1 3.28Å; K575-I579 WeakPolarHBondContact O-CG1 3.33Å; K575-I579 PolarHBondContact O-N 2.91Å; D576-I579 PolarHBondContact O-N 3.14Å; I579-L581 PolarHBondContact O-N 3.44Å; I579-G582 PolarHBondContact O-N 2.71Å
580	K	94.2	Very high	93.6	Very high	142 Å²	142	64 Å²	64	62%	0.617	35%	0.35	S	S	*	.	H	α-helix	trans	-61.1	-24.3	175.9	-74.8	169.4	-177.9	179.1	0	113.6	T300 V304 D576 A577 G582	T300-K580 WeakPolarHBondContact CG2-O 3.12Å; V304-K580 HydrophobicContact CG2-CB 4.06Å; V304-K580 HydrophobicContact CG2-CD 4.42Å; D576-K580 VanDerWaalsContact O-CG 3.27Å; D576-K580 WeakPolarHBondContact O-CG 3.17Å; D576-K580 PolarHBondContact O-N 3.12Å; A577-K580 PolarHBondContact O-N 3.47Å; K580-G582 VanDerWaalsContact C-N 3.34Å
581	L	93.5	Very high	93.8	Very high	2 Å²	2	63 Å²	63	1%	0.01	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.2	176.7	-66	167.4	0	0	0	113.3	Y293 L301 V304 M570 L573 A577 I578 I579 L584	Y293-L581 VanDerWaalsContact CE2-O 3.25Å; Y293-L581 WeakPolarHBondContact CE2-O 3.21Å; Y293-L581 WeakPolarHBondContact OH-CA 3.23Å; Y293-L581 PolarHBondContact OH-O 3.44Å; L301-L581 HydrophobicContact CD1-CD2 3.8Å; V304-L581 HydrophobicContact CB-CD2 4.16Å; V304-L581 HydrophobicContact CB-CG 4.43Å; V304-L581 HydrophobicContact CG1-CD1 3.89Å; V304-L581 HydrophobicContact CG1-CD2 4.25Å; V304-L581 HydrophobicContact CG1-CG 4.05Å; V304-L581 HydrophobicContact CG2-CD2 4.38Å; M570-L581 HydrophobicContact SD-CD1 4.23Å; L573-L581 HydrophobicContact CD1-CD1 3.43Å; L573-L581 VanDerWaalsContact CD1-CD1 3.43Å; A577-L581 WeakPolarHBondContact O-CG 3.46Å; A577-L581 PolarHBondContact O-N 2.89Å; I578-L581 PolarHBondContact O-N 3.19Å; I578-L581 VanDerWaalsContact O-N 3.17Å; I579-L581 PolarHBondContact O-N 3.44Å; L581-L584 HydrophobicContact CB-CB 4.21Å; L581-L584 HydrophobicContact CB-CD2 4.2Å; L581-L584 HydrophobicContact CD1-CD2 4.2Å; L581-L584 HydrophobicContact CD2-CD2 4.05Å; L581-L584 HydrophobicContact CG-CD2 4.38Å; L581-L584 PolarHBondContact O-N 3.01Å
582	G	94	Very high	94	Very high	47 Å²	47	58.8 Å²	58.8	49%	0.485	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-120.2	170.7	0	0	0	0	0	113.3	I579 K580 L584 P585	I579-G582 PolarHBondContact O-N 2.71Å; K580-G582 VanDerWaalsContact C-N 3.34Å; G582-L584 VanDerWaalsContact C-N 3.31Å; G582-L584 PolarHBondContact O-N 2.71Å; G582-P585 WeakPolarHBondContact O-CD 3.42Å
583	P	95.7	Very high	94	Very high	69 Å²	69	57.6 Å²	57.6	45%	0.448	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-14.5	-176.1	32	-37.1	0	0	0	114.4	Y293 R586 L587	Y293-P583 HydrophobicContact CD2-CG 3.81Å; Y293-P583 HydrophobicContact CE2-CG 4.08Å; P583-R586 WeakPolarHBondContact O-CB 3.36Å; P583-R586 PolarHBondContact O-N 2.9Å; P583-L587 PolarHBondContact O-N 3.31Å
584	L	95.4	Very high	93.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-50.1	-42.9	-174.4	179.1	65.7	0	0	0	115	F290 Y293 L301 L566 L581 G582 R586 L587 L588	F290-L584 HydrophobicContact CD2-CD1 3.83Å; F290-L584 HydrophobicContact CE2-CD1 3.68Å; Y293-L584 HydrophobicContact CD1-CB 4.3Å; Y293-L584 HydrophobicContact CD1-CD1 3.88Å; Y293-L584 HydrophobicContact CD1-CG 4.5Å; Y293-L584 HydrophobicContact CE1-CB 3.82Å; Y293-L584 HydrophobicContact CE1-CD1 3.89Å; Y293-L584 HydrophobicContact CE1-CD2 3.86Å; Y293-L584 HydrophobicContact CE1-CG 4.07Å; Y293-L584 HydrophobicContact CE2-CB 4.13Å; L301-L584 HydrophobicContact CD1-CD2 3.73Å; L566-L584 HydrophobicContact CD1-CD1 4.33Å; L566-L584 HydrophobicContact CD1-CD2 4.41Å; L581-L584 HydrophobicContact CB-CB 4.21Å; L581-L584 HydrophobicContact CB-CD2 4.2Å; L581-L584 HydrophobicContact CD1-CD2 4.2Å; L581-L584 HydrophobicContact CD2-CD2 4.05Å; L581-L584 HydrophobicContact CG-CD2 4.38Å; L581-L584 PolarHBondContact O-N 3.01Å; G582-L584 VanDerWaalsContact C-N 3.31Å; G582-L584 PolarHBondContact O-N 2.71Å; L584-R586 VanDerWaalsContact C-N 3.27Å; L584-R586 PolarHBondContact O-N 2.87Å; L584-L587 PolarHBondContact O-N 3.04Å; L584-L587 VanDerWaalsContact O-N 3.16Å; L584-L588 HydrophobicContact CD1-CD1 3.9Å; L584-L588 HydrophobicContact CD1-CD2 4.06Å; L584-L588 HydrophobicContact CD1-CG 3.73Å; L584-L588 HydrophobicContact CD2-CD1 4.36Å; L584-L588 HydrophobicContact CG-CD1 3.81Å; L584-L588 HydrophobicContact CG-CG 4.09Å; L584-L588 WeakPolarHBondContact O-CG 3.47Å; L584-L588 PolarHBondContact O-N 2.83Å
585	P	95	Very high	93.8	Very high	39 Å²	39	56.5 Å²	56.5	25%	0.253	30%	0.297	S	S	.	.	H	α-helix	trans	-62.3	-33.6	-179.9	-20.6	33.7	0	0	0	112.9	M570 I578 G582 N589	M570-P585 HydrophobicContact CE-CB 4.03Å; M570-P585 HydrophobicContact CE-CG 3.78Å; I578-P585 HydrophobicContact CG2-CB 4.45Å; I578-P585 HydrophobicContact CG2-CG 3.71Å; G582-P585 WeakPolarHBondContact O-CD 3.42Å; P585-N589 WeakPolarHBondContact O-CB 3.27Å; P585-N589 PolarHBondContact O-N 3.02Å; P585-N589 VanDerWaalsContact O-N 3.16Å
586	R	95.7	Very high	93.6	Very high	113 Å²	113	55.4 Å²	55.4	43%	0.426	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-54.2	171.7	178.5	-174.3	67.2	78.7	-10.7	109.9	E289 P583 L584 L588 N589 D590	E289-R586 IonicContact OE1-NH2 3.69Å; E289-R586 PolarHBondContact OE1-NH2 2.94Å; E289-R586 IonicContact OE2-CZ 2.76Å; E289-R586 IonicContact OE2-NH1 2.72Å; E289-R586 PolarHBondContact OE2-NH1 2.76Å; E289-R586 VanDerWaalsContact OE2-NH1 3.1Å; E289-R586 IonicContact OE2-NH2 2.74Å; E289-R586 PolarHBondContact OE2-NH2 3.01Å; P583-R586 WeakPolarHBondContact O-CB 3.36Å; P583-R586 PolarHBondContact O-N 2.9Å; L584-R586 VanDerWaalsContact C-N 3.27Å; L584-R586 PolarHBondContact O-N 2.87Å; R586-L588 VanDerWaalsContact C-N 3.29Å; R586-L588 PolarHBondContact O-N 2.91Å; R586-N589 CarbonylContact O-C 3.58Å; R586-N589 WeakPolarHBondContact O-CA 3.42Å; R586-N589 WeakPolarHBondContact O-CB 3.34Å; R586-N589 PolarHBondContact O-N 3.49Å; R586-D590 VanDerWaalsContact CG-OD2 3.27Å; R586-D590 WeakPolarHBondContact CG-OD2 3.47Å; R586-D590 IonicContact CZ-OD2 2.71Å; R586-D590 IonicContact NH1-OD2 3.01Å; R586-D590 PolarHBondContact NH1-OD2 2.94Å; R586-D590 VanDerWaalsContact O-CG 3.22Å; R586-D590 PolarHBondContact O-N 3.48Å
587	L	96.7	Very high	93.2	Very high	8 Å²	8	53.8 Å²	53.8	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-54.7	-45.3	-177.1	-60.4	176.7	0	0	0	112	E289 F290 Y293 P583 L584 D590 I591	E289-L587 HydrophobicContact CB-CD1 4.42Å; E289-L587 HydrophobicContact CB-CD2 3.53Å; E289-L587 HydrophobicContact CG-CD2 4.35Å; E289-L587 WeakPolarHBondContact OE2-CD2 3.48Å; F290-L587 HydrophobicContact CB-CB 4.5Å; Y293-L587 HydrophobicContact CG-CD1 4.24Å; P583-L587 PolarHBondContact O-N 3.31Å; L584-L587 PolarHBondContact O-N 3.04Å; L584-L587 VanDerWaalsContact O-N 3.16Å; L587-D590 PolarHBondContact O-N 3.02Å; L587-I591 WeakPolarHBondContact O-CD1 3.47Å; L587-I591 WeakPolarHBondContact O-CG1 3.37Å; L587-I591 PolarHBondContact O-N 2.72Å; L587-I591 VanDerWaalsContact O-N 3.13Å
588	L	96.3	Very high	92.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-35.5	176.8	-61.9	174.6	0	0	0	112.2	F290 H563 L566 W567 M570 L584 R586 S592	F290-L588 HydrophobicContact CD2-CD2 4.21Å; F290-L588 HydrophobicContact CE2-CD2 3.73Å; F290-L588 HydrophobicContact CZ-CD2 4.03Å; H563-L588 HydrophobicContact CB-CD2 4.45Å; H563-L588 PolarHBondContact NE2-O 3.32Å; L566-L588 HydrophobicContact CB-CD1 3.72Å; L566-L588 HydrophobicContact CB-CD2 4.14Å; L566-L588 HydrophobicContact CD1-CD2 4.31Å; W567-L588 HydrophobicContact CE3-CB 3.89Å; W567-L588 HydrophobicContact CZ3-CB 4.29Å; M570-L588 HydrophobicContact CG-CD1 3.61Å; M570-L588 HydrophobicContact SD-CD1 4.02Å; L584-L588 HydrophobicContact CD1-CD1 3.9Å; L584-L588 HydrophobicContact CD1-CD2 4.06Å; L584-L588 HydrophobicContact CD1-CG 3.73Å; L584-L588 HydrophobicContact CD2-CD1 4.36Å; L584-L588 HydrophobicContact CG-CD1 3.81Å; L584-L588 HydrophobicContact CG-CG 4.09Å; L584-L588 WeakPolarHBondContact O-CG 3.47Å; L584-L588 PolarHBondContact O-N 2.83Å; R586-L588 VanDerWaalsContact C-N 3.29Å; R586-L588 PolarHBondContact O-N 2.91Å; L588-S592 VanDerWaalsContact O-CB 3.26Å; L588-S592 WeakPolarHBondContact O-CB 3.35Å; L588-S592 PolarHBondContact O-N 2.97Å; L588-S592 PolarHBondContact O-OG 3.3Å
589	N	95.3	Very high	90.6	Very high	56 Å²	56	61.7 Å²	61.7	30%	0.299	32%	0.319	S	S	.	.	H	α-helix	trans	-68.1	-43.3	174.9	176.4	74.2	0	0	0	112.3	W567 P585 R586 S592 M593	W567-N589 HydrophobicContact CH2-CB 4.21Å; W567-N589 HydrophobicContact CZ3-CB 4Å; P585-N589 WeakPolarHBondContact O-CB 3.27Å; P585-N589 PolarHBondContact O-N 3.02Å; P585-N589 VanDerWaalsContact O-N 3.16Å; R586-N589 CarbonylContact O-C 3.58Å; R586-N589 WeakPolarHBondContact O-CA 3.42Å; R586-N589 WeakPolarHBondContact O-CB 3.34Å; R586-N589 PolarHBondContact O-N 3.49Å; N589-S592 CarbonylContact O-C 3.52Å; N589-S592 WeakPolarHBondContact O-CA 3.26Å; N589-S592 WeakPolarHBondContact O-CB 3.28Å; N589-S592 PolarHBondContact O-N 2.99Å; N589-S592 VanDerWaalsContact O-N 3.11Å; N589-M593 PolarHBondContact ND2-SD 2.95Å; N589-M593 VanDerWaalsContact ND2-SD 3.36Å; N589-M593 WeakPolarHBondContact O-CG 3.41Å; N589-M593 PolarHBondContact O-N 3.36Å
590	D	94.6	Very high	88.8	Confident	67 Å²	67	62.1 Å²	62.1	36%	0.358	32%	0.322	S	S	.	.	H	α-helix	trans	-63.8	-44.7	-177.8	-61.3	-12.9	0	0	0	110.3	R586 L587 M593 A594	R586-D590 VanDerWaalsContact CG-OD2 3.27Å; R586-D590 WeakPolarHBondContact CG-OD2 3.47Å; R586-D590 IonicContact CZ-OD2 2.71Å; R586-D590 IonicContact NH1-OD2 3.01Å; R586-D590 PolarHBondContact NH1-OD2 2.94Å; R586-D590 VanDerWaalsContact O-CG 3.22Å; R586-D590 PolarHBondContact O-N 3.48Å; L587-D590 PolarHBondContact O-N 3.02Å; D590-M593 PolarHBondContact O-N 3.32Å; D590-M593 VanDerWaalsContact O-N 3.17Å; D590-A594 PolarHBondContact O-N 3.47Å
591	I	95.2	Very high	86.8	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-46.5	170.1	-65.8	162.8	0	0	0	110.6	L282 Y287 F290 H563 L587 M593 A594 L595	L282-I591 HydrophobicContact CD1-CG2 4.04Å; Y287-I591 HydrophobicContact CD1-CD1 3.88Å; Y287-I591 HydrophobicContact CD1-CG1 4.28Å; Y287-I591 HydrophobicContact CD1-CG2 4.32Å; Y287-I591 HydrophobicContact CE1-CD1 4.39Å; Y287-I591 HydrophobicContact CE1-CG2 3.79Å; F290-I591 HydrophobicContact CB-CD1 3.78Å; F290-I591 HydrophobicContact CD1-CD1 3.89Å; F290-I591 HydrophobicContact CG-CD1 3.91Å; H563-I591 HydrophobicContact CB-CG2 4.43Å; H563-I591 WeakPolarHBondContact CD2-CG2 2.94Å; H563-I591 WeakPolarHBondContact NE2-CG2 3.12Å; L587-I591 WeakPolarHBondContact O-CD1 3.47Å; L587-I591 WeakPolarHBondContact O-CG1 3.37Å; L587-I591 PolarHBondContact O-N 2.72Å; L587-I591 VanDerWaalsContact O-N 3.13Å; I591-M593 PolarHBondContact O-N 3.48Å; I591-A594 PolarHBondContact O-N 3.14Å; I591-L595 HydrophobicContact CG2-CD1 3.96Å; I591-L595 HydrophobicContact CG2-CG 4.27Å; I591-L595 WeakPolarHBondContact O-CB 3.26Å; I591-L595 WeakPolarHBondContact O-CG 3.39Å; I591-L595 PolarHBondContact O-N 2.88Å
592	S	94.6	Very high	84.3	Confident	7 Å²	7	70.6 Å²	70.6	5%	0.049	35%	0.353	C	S	.	.	H	α-helix	trans	-60.6	-30.2	176.1	-73.7	0	0	0	0	113	H563 W567 L588 N589 R596	H563-S592 PolarHBondContact CE1-OG 2.6Å; H563-S592 PolarHBondContact NE2-OG 2.86Å; H563-S592 VanDerWaalsContact NE2-OG 3.11Å; W567-S592 VanDerWaalsContact CD2-OG 3.29Å; L588-S592 VanDerWaalsContact O-CB 3.26Å; L588-S592 WeakPolarHBondContact O-CB 3.35Å; L588-S592 PolarHBondContact O-N 2.97Å; L588-S592 PolarHBondContact O-OG 3.3Å; N589-S592 CarbonylContact O-C 3.52Å; N589-S592 WeakPolarHBondContact O-CA 3.26Å; N589-S592 WeakPolarHBondContact O-CB 3.28Å; N589-S592 PolarHBondContact O-N 2.99Å; N589-S592 VanDerWaalsContact O-N 3.11Å; S592-R596 WeakPolarHBondContact O-CB 3.32Å; S592-R596 VanDerWaalsContact O-CG 3.32Å; S592-R596 WeakPolarHBondContact O-CG 3.41Å; S592-R596 PolarHBondContact O-N 2.72Å; S592-R596 PolarHBondContact O-NE 3.05Å
593	M	92.6	Very high	81.5	Confident	91 Å²	91	76.3 Å²	76.3	45%	0.448	37%	0.368	S	S	.	.	H	α-helix	trans	-74.6	-42.6	174.8	-75.1	179.7	61.3	0	0	111.6	N589 D590 I591 R596 N597	N589-M593 PolarHBondContact ND2-SD 2.95Å; N589-M593 VanDerWaalsContact ND2-SD 3.36Å; N589-M593 WeakPolarHBondContact O-CG 3.41Å; N589-M593 PolarHBondContact O-N 3.36Å; D590-M593 PolarHBondContact O-N 3.32Å; D590-M593 VanDerWaalsContact O-N 3.17Å; I591-M593 PolarHBondContact O-N 3.48Å; M593-R596 PolarHBondContact O-N 2.94Å; M593-N597 WeakPolarHBondContact O-CB 3.23Å; M593-N597 PolarHBondContact O-N 3.38Å; M593-N597 VanDerWaalsContact O-N 3.12Å; M593-N597 PolarHBondContact O-ND2 3.49Å
594	A	90.6	Very high	78.7	Confident	22 Å²	22	78.4 Å²	78.4	18%	0.182	38%	0.381	C	S	.	.	H	α-helix	trans	-65.9	-39.8	174.9	0	0	0	0	0	112.6	R144 L282 L286 D590 I591 R596 N597	R144-A594 PolarHBondContact NH1-O 3.38Å; L282-A594 HydrophobicContact CD1-CB 3.61Å; L282-A594 HydrophobicContact CD2-CB 4.26Å; L286-A594 HydrophobicContact CD1-CB 3.84Å; D590-A594 PolarHBondContact O-N 3.47Å; I591-A594 PolarHBondContact O-N 3.14Å; A594-R596 VanDerWaalsContact C-N 3.34Å; A594-R596 PolarHBondContact O-N 2.55Å; A594-N597 PolarHBondContact O-N 2.93Å
595	L	90.2	Very high	75.7	Confident	40 Å²	40	83.4 Å²	83.4	21%	0.209	42%	0.416	C	S	.	.	H	α-helix	trans	-57.9	-45.1	172.7	-74.1	173	0	0	0	111.6	R144 N280 L282 I591 N597	R144-L595 PolarHBondContact NH2-O 3.27Å; N280-L595 HydrophobicContact CB-CD2 3.98Å; N280-L595 WeakPolarHBondContact O-CD2 3.26Å; L282-L595 HydrophobicContact CD1-CD2 4.25Å; L282-L595 HydrophobicContact CD1-CG 4.14Å; L282-L595 HydrophobicContact CD2-CD2 4Å; L282-L595 HydrophobicContact CD2-CG 4.49Å; L282-L595 HydrophobicContact CG-CD2 3.84Å; L282-L595 HydrophobicContact CG-CG 4.28Å; I591-L595 HydrophobicContact CG2-CD1 3.96Å; I591-L595 HydrophobicContact CG2-CG 4.27Å; I591-L595 WeakPolarHBondContact O-CB 3.26Å; I591-L595 WeakPolarHBondContact O-CG 3.39Å; I591-L595 PolarHBondContact O-N 2.88Å; L595-N597 VanDerWaalsContact C-N 3.34Å; L595-N597 PolarHBondContact O-N 3.48Å
596	R	87.9	Confident	72.9	Confident	151 Å²	151	90.7 Å²	90.7	57%	0.57	45%	0.446	S	S	*	.	H	α-helix	trans	-73.3	-16.9	-180	-75.8	177.6	-72.5	-174.3	1	114.8	S592 M593 A594 P598	S592-R596 WeakPolarHBondContact O-CB 3.32Å; S592-R596 VanDerWaalsContact O-CG 3.32Å; S592-R596 WeakPolarHBondContact O-CG 3.41Å; S592-R596 PolarHBondContact O-N 2.72Å; S592-R596 PolarHBondContact O-NE 3.05Å; M593-R596 PolarHBondContact O-N 2.94Å; A594-R596 VanDerWaalsContact C-N 3.34Å; A594-R596 PolarHBondContact O-N 2.55Å; R596-P598 WeakPolarHBondContact O-CD 3.26Å
597	N	83.9	Confident	69.9	Low	74 Å²	74	94.8 Å²	94.8	40%	0.396	47%	0.47	S	S	.	.			trans	-122.5	85.4	-174.5	-69.5	-75.1	0	0	0	113	M593 A594 L595 H599 L600	M593-N597 WeakPolarHBondContact O-CB 3.23Å; M593-N597 PolarHBondContact O-N 3.38Å; M593-N597 VanDerWaalsContact O-N 3.12Å; M593-N597 PolarHBondContact O-ND2 3.49Å; A594-N597 PolarHBondContact O-N 2.93Å; L595-N597 VanDerWaalsContact C-N 3.34Å; L595-N597 PolarHBondContact O-N 3.48Å; N597-H599 PolarHBondContact O-N 2.86Å; N597-H599 VanDerWaalsContact O-N 3.08Å; N597-L600 HydrophobicContact CB-CD1 3.62Å; N597-L600 HydrophobicContact CB-CG 3.95Å
598	P	69.1	Low	66.7	Low	75 Å²	75	99.5 Å²	99.5	49%	0.487	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.2	-179	-25.6	35.2	0	0	0	115.9	R596	R596-P598 WeakPolarHBondContact O-CD 3.26Å
599	H	58.8	Low	63.7	Low	161 Å²	161	106.6 Å²	106.6	75%	0.745	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-15.6	-169.4	-60	-63	0	0	0	115	N597 Q601	N597-H599 PolarHBondContact O-N 2.86Å; N597-H599 VanDerWaalsContact O-N 3.08Å; H599-Q601 PolarHBondContact O-N 2.85Å; H599-Q601 VanDerWaalsContact O-N 3.15Å
600	L	55.8	Low	60.7	Low	135 Å²	135	115.1 Å²	115.1	71%	0.707	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-12.9	-177.2	-73.5	176.3	0	0	0	114.1	N597	N597-L600 HydrophobicContact CB-CD1 3.62Å; N597-L600 HydrophobicContact CB-CG 3.95Å
601	Q	52.1	Low	57.6	Low	83 Å²	83	117.9 Å²	117.9	39%	0.388	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.2	14.4	-173.5	-148.5	159.2	14.6	0	0	114.2	H599 Q603	H599-Q601 PolarHBondContact O-N 2.85Å; H599-Q601 VanDerWaalsContact O-N 3.15Å; Q601-Q603 VanDerWaalsContact C-N 3.34Å; Q601-Q603 PolarHBondContact O-N 3.32Å
602	R	41.1	Very low	54.5	Low	239 Å²	239	127.4 Å²	127.4	90%	0.902	64%	0.64	S	S	*	*			trans	-81.2	78.3	160.4	-82	-167.9	175.5	-171.8	-0.2	110.4
603	Q	34.3	Very low	51.3	Low	168 Å²	168	132.3 Å²	132.3	79%	0.785	67%	0.666	S	S	*	*			trans	-88.3	145.6	158	-85.3	-77.6	-5.2	0	0	109.5	Q601	Q601-Q603 VanDerWaalsContact C-N 3.34Å; Q601-Q603 PolarHBondContact O-N 3.32Å
604	P	37	Very low	48.2	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	68%	0.683	S	S	*	*			trans	-100.2	125.1	-170.6	35.4	-27.2	0	0	0	112.6
605	S	33.3	Very low	45.2	Very low	105 Å²	105	146.1 Å²	146.1	73%	0.734	72%	0.716	S	S	*	*			trans	-144.3	28.9	-177.3	53.2	0	0	0	0	115.7
606	H	36.7	Very low	42.1	Very low	193 Å²	193	149.7 Å²	149.7	89%	0.894	74%	0.744	S	S	*	*	S	Bend	trans	-150	42.8	166.9	-87.2	-49.6	0	0	0	114.6
607	Q	31.5	Very low	39.2	Very low	198 Å²	198	148.2 Å²	148.2	93%	0.925	75%	0.748	S	S	*	*			trans	-153.5	69.2	164.7	-143.1	163.7	70.8	0	0	112.8
608	A	30.6	Very low	36.5	Very low	108 Å²	108	154.7 Å²	154.7	89%	0.893	77%	0.767	S	S	*	*	S	Bend	trans	-127.6	25.8	175.7	0	0	0	0	0	112.5
609	D	33.3	Very low	34.5	Very low	148 Å²	148	158.9 Å²	158.9	79%	0.791	78%	0.784	S	S	*	*			trans	-155.4	97.2	168	-161.1	-8	0	0	0	111.7
610	R	31.4	Very low	33.1	Very low	235 Å²	235	159 Å²	159	89%	0.887	79%	0.79	S	S	*	*	S	Bend	trans	179.4	129.9	148.9	-103.5	163.6	-166.7	-157.1	1.4	113.2
611	V	29.1	Very low	31.5	Very low	125 Å²	125	157.8 Å²	157.8	76%	0.758	79%	0.792	S	S	*	*			trans	61.2	81.9	161.1	-166.3	0	0	0	0	115.9	D613	V611-D613 HydrophobicContact CG1-CB 3.99Å
612	Q	30.6	Very low	30.4	Very low	205 Å²	205	164.4 Å²	164.4	96%	0.958	81%	0.814	S	S	*	*			trans	-82.7	95.5	146.8	-178	179	24.6	0	0	108.3
613	D	28.4	Very low	30.1	Very low	111 Å²	111	158.5 Å²	158.5	59%	0.594	81%	0.806	S	S	*	*			trans	-145.1	150.4	167.3	-169.1	21.1	0	0	0	110.9	V611	V611-D613 HydrophobicContact CG1-CB 3.99Å
614	R	27.1	Very low	29.7	Very low	217 Å²	217	153.8 Å²	153.8	82%	0.819	79%	0.791	S	S	*	*			trans	61.9	87.4	171.7	-44.9	-163	179.4	-157.1	-8.8	117.9
615	Q	26.7	Very low	29.3	Very low	185 Å²	185	157 Å²	157	86%	0.864	80%	0.795	S	S	*	*			trans	-69.4	172.3	139.1	-78.7	-173.7	-25.4	0	0	111.3
616	S	26.4	Very low	29	Very low	115 Å²	115	157.6 Å²	157.6	80%	0.804	79%	0.789	S	S	*	*			trans	60	104.1	171.7	59.3	0	0	0	0	117.5
617	D	26.3	Very low	28.7	Very low	121 Å²	121	159.2 Å²	159.2	65%	0.647	79%	0.788	S	S	*	*				-152.6	150.7	100.9	-139.3	-20	0	0	0	114.4
618	R	27.5	Very low	28.4	Very low	209 Å²	209	153 Å²	153	79%	0.789	78%	0.776	S	S	*	*			trans	31.1	124.3	159.2	-86.1	159.8	-97.6	-148.2	-1.2	123.6
619	L	27.2	Very low	28.3	Very low	163 Å²	163	156 Å²	156	85%	0.853	78%	0.776	S	S	*	*			trans	-49.5	150	146.6	-58.4	158	0	0	0	112.6
620	L	27.8	Very low	28	Very low	165 Å²	165	153.7 Å²	153.7	86%	0.864	77%	0.771	S	S	*	*				-177.3	151.9	129.8	-103.3	167.9	0	0	0	115.7
621	S	24.1	Very low	28	Very low	108 Å²	108	147.5 Å²	147.5	76%	0.755	76%	0.763	S	S	*	*			trans	56.9	117.3	152.8	55.6	0	0	0	0	122.8
622	R	27.3	Very low	28.2	Very low	223 Å²	223	149.6 Å²	149.6	84%	0.842	77%	0.765	S	S	*	*			trans	-106.4	141.3	149.6	-172.4	-167.3	177.2	-176.8	3.2	107.5	S624	R622-S624 PolarHBondContact NE-OG 2.71Å
623	P	34.8	Very low	28.1	Very low	115 Å²	115	146.7 Å²	146.7	75%	0.747	75%	0.75	S	S	*	*				-133.4	155.3	106.2	9.4	13.5	0	0	0	111.4
624	S	26.7	Very low	28.2	Very low	68 Å²	68	147.7 Å²	147.7	48%	0.476	75%	0.751	S	S	.	*			cis	86.6	109.6	36.2	-57.4	0	0	0	0	115.2	R622	R622-S624 PolarHBondContact NE-OG 2.71Å
625	F	27.9	Very low	28.4	Very low	181 Å²	181	143 Å²	143	79%	0.794	74%	0.742	S	S	*	*				170.6	146.8	109.1	-100.8	-68.5	0	0	0	117.6
626	N	28.1	Very low	28.6	Very low	117 Å²	117	140.2 Å²	140.2	63%	0.626	73%	0.732	S	S	*	*			trans	64.6	151.8	148.8	-73.5	-33.2	0	0	0	121.8
627	R	30	Very low	28.7	Very low	227 Å²	227	142.7 Å²	142.7	86%	0.857	73%	0.733	S	S	*	*			cis	-172.5	145.4	-21.3	176.7	-178.1	-78.6	-147.4	-3.1	111.6
628	G	26	Very low	29	Very low	66 Å²	66	144 Å²	144	68%	0.68	74%	0.737	S	S	*	*			trans	105.5	150.2	156.8	0	0	0	0	0	115.8
629	I	27.9	Very low	29.1	Very low	173 Å²	173	143.9 Å²	143.9	89%	0.887	74%	0.737	S	S	*	*			cis	-141.6	159.9	1.6	-61.2	-179.4	0	0	0	109.9
630	S	26.6	Very low	29.1	Very low	99 Å²	99	141.7 Å²	141.7	69%	0.692	73%	0.726	S	S	*	*			trans	-60.4	158.5	176.8	-137.2	0	0	0	0	114
631	S	31.8	Very low	29.3	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	72%	0.718	S	S	*	*			cis	77.9	113.4	21.6	169.2	0	0	0	0	117.7
632	E	32.9	Very low	29.5	Very low	169 Å²	169	141.9 Å²	141.9	79%	0.79	72%	0.719	S	S	*	*			trans	-156.9	151.3	156.2	-71.1	-151	141.8	0	0	108
633	F	28.1	Very low	29.5	Very low	145 Å²	145	136.5 Å²	136.5	64%	0.636	72%	0.715	S	S	*	*			cis	-153.1	132.9	-1.3	-131.9	-127.2	0	0	0	107.1
634	Q	31.7	Very low	29.1	Very low	132 Å²	132	136 Å²	136	62%	0.617	71%	0.714	S	S	*	*				72.8	153.1	75.9	-71.4	-168	19.9	0	0	115.5
635	N	30.6	Very low	29.3	Very low	118 Å²	118	141 Å²	141	63%	0.631	73%	0.734	S	S	*	*			cis	-160.8	171.8	0.8	-105.5	-9.6	0	0	0	108.9
636	L	30.6	Very low	29.3	Very low	127 Å²	127	139.1 Å²	139.1	67%	0.665	73%	0.732	S	S	*	*			cis	-130.6	-133	-9.1	-154.2	72.9	0	0	0	107.5	M638	L636-M638 HydrophobicContact CD2-CG 3.91Å
637	M	29.9	Very low	29.3	Very low	166 Å²	166	139.8 Å²	139.8	82%	0.818	73%	0.734	S	S	*	*			cis	-138.2	142.3	-0.9	-90.3	-159.9	-73.2	0	0	107.4
638	M	31.7	Very low	29.4	Very low	148 Å²	148	134.3 Å²	134.3	73%	0.729	73%	0.726	S	S	*	*				52.4	127.2	85.9	-62.3	-62.7	-172.3	0	0	115.4	L636	L636-M638 HydrophobicContact CD2-CG 3.91Å
639	R	28.6	Very low	29.5	Very low	208 Å²	208	142.6 Å²	142.6	79%	0.785	74%	0.737	S	S	*	*			cis	-162.7	153.9	24.1	-157.3	172.7	-176	168.2	6.6	114.6
640	D	28.7	Very low	29.6	Very low	116 Å²	116	142 Å²	142	62%	0.62	73%	0.734	S	S	*	*			trans	11.6	155.5	149.2	-47.8	-26.2	0	0	0	122
641	L	32.4	Very low	30.1	Very low	134 Å²	134	143.1 Å²	143.1	70%	0.702	74%	0.74	S	S	*	*			cis	-173.5	155.8	-11.2	-107	170	0	0	0	109.6
642	N	27.3	Very low	30.2	Very low	144 Å²	144	143.5 Å²	143.5	77%	0.77	74%	0.742	S	S	*	*			trans	61.6	159.4	157.4	-70.2	-14.1	0	0	0	119.1
643	S	26.3	Very low	30.5	Very low	110 Å²	110	141.3 Å²	141.3	77%	0.769	74%	0.743	S	S	*	*			cis	-155.8	166.5	-13.4	43.4	0	0	0	0	110.5
644	S	27.5	Very low	30.4	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	75%	0.752	S	S	*	*			trans	-77.8	158.9	176.8	52	0	0	0	0	114.7
645	I	31.2	Very low	30.6	Very low	172 Å²	172	139.6 Å²	139.6	88%	0.882	76%	0.758	S	S	*	*				-174.7	166.4	125.2	-94.8	158.1	0	0	0	109.8
646	D	28.3	Very low	30.5	Very low	142 Å²	142	140.8 Å²	140.8	76%	0.759	77%	0.769	S	S	*	*			trans	-120.8	-177.8	-162.4	-174.6	14.7	0	0	0	111.7
647	I	28.2	Very low	30.5	Very low	132 Å²	132	138.4 Å²	138.4	68%	0.677	78%	0.776	S	S	*	*			trans	98	135.5	155.9	-58.6	169.2	0	0	0	119.7
648	T	30.6	Very low	30.6	Very low	112 Å²	112	134.1 Å²	134.1	69%	0.687	77%	0.774	S	S	*	*			trans	85.1	110.1	157.3	40.4	0	0	0	0	124.8
649	R	28.7	Very low	30.4	Very low	239 Å²	239	134.1 Å²	134.1	90%	0.902	78%	0.782	S	S	*	*				73.3	131.3	125.5	-68.8	176.1	-170.9	-132	2.8	123.6
650	L	30.7	Very low	30.6	Very low	160 Å²	160	132.4 Å²	132.4	84%	0.838	79%	0.785	S	S	*	*			trans	-29.7	156.1	151.6	-69.1	171.9	0	0	0	116.3
651	P	35.6	Very low	32	Very low	124 Å²	124	132.1 Å²	132.1	81%	0.805	79%	0.79	S	S	*	*				-151.1	-173.3	52	43.7	-23.2	0	0	0	119
652	S	34.1	Very low	32	Very low	111 Å²	111	131.2 Å²	131.2	78%	0.776	79%	0.794	S	S	*	*			trans	-109.4	151.6	173.7	-42.8	0	0	0	0	112.6
653	P	39.6	Very low	32.5	Very low	124 Å²	124	134.6 Å²	134.6	81%	0.805	80%	0.796	S	S	*	*			trans	-141.1	176.9	159.7	39.9	-24.4	0	0	0	116.2
654	T	27.3	Very low	32.6	Very low	135 Å²	135	133.5 Å²	133.5	83%	0.828	79%	0.794	S	S	*	*			trans	-158	156.6	-174.9	48.2	0	0	0	0	111.4
655	S	34.3	Very low	32.9	Very low	105 Å²	105	135.4 Å²	135.4	73%	0.734	79%	0.791	S	S	*	*			cis	-162.1	-104.1	-15	55.4	0	0	0	0	110.8
656	T	30.1	Very low	32.8	Very low	143 Å²	143	134.1 Å²	134.1	88%	0.877	79%	0.786	S	S	*	*			trans	58.3	155.6	174.7	70.9	0	0	0	0	118.7
657	G	30	Very low	32.7	Very low	78 Å²	78	131 Å²	131	80%	0.804	78%	0.775	S	S	*	*			cis	172.3	168.2	-10.7	0	0	0	0	0	114.8
658	G	30.8	Very low	32.7	Very low	76 Å²	76	133.9 Å²	133.9	78%	0.784	78%	0.783	S	S	*	*			trans	109.3	153.1	170.7	0	0	0	0	0	116.6
659	V	28.2	Very low	32.4	Very low	147 Å²	147	137.8 Å²	137.8	89%	0.891	79%	0.793	S	S	*	*			cis	-151	166.7	2.7	-175.3	0	0	0	0	111.3
660	M	32.2	Very low	32.4	Very low	173 Å²	173	133.7 Å²	133.7	85%	0.852	79%	0.789	S	S	*	*			trans	-109.2	-164.1	-176.5	-73.2	-77.9	-169.8	0	0	112.3
661	P	59.3	Low	32.2	Very low	110 Å²	110	136.3 Å²	136.3	71%	0.714	79%	0.788	S	S	*	*			cis	-146.5	-166	4	42.9	-19.7	0	0	0	118.9
662	S	31.4	Very low	31.5	Very low	114 Å²	114	136.8 Å²	136.8	80%	0.797	78%	0.784	S	S	*	*			trans	92.6	149.2	152.4	-58.7	0	0	0	0	122.2
663	R	37.5	Very low	31.2	Very low	216 Å²	216	139.9 Å²	139.9	82%	0.815	79%	0.786	S	S	*	*			cis	-171.1	154.6	-28.8	176.3	171.1	169.8	147.7	2.3	111.9
664	A	29.4	Very low	31.1	Very low	87 Å²	87	138.3 Å²	138.3	72%	0.719	78%	0.775	S	S	*	*			trans	94.2	153.6	156.9	0	0	0	0	0	120
665	Q	34	Very low	31	Very low	143 Å²	143	140.3 Å²	140.3	67%	0.668	78%	0.775	S	S	*	*			cis	-167	163.9	-34.7	-174.6	163.1	-28.9	0	0	110.4
666	L	28	Very low	30.6	Very low	146 Å²	146	146.8 Å²	146.8	76%	0.764	78%	0.783	S	S	*	*			trans	81.1	115.6	178.6	-50.3	171.7	0	0	0	113.2
667	S	26.6	Very low	30.4	Very low	77 Å²	77	145 Å²	145	54%	0.538	78%	0.783	S	S	.	*			cis	67	133	16.6	83	0	0	0	0	116
668	F	28	Very low	30.3	Very low	192 Å²	192	146.9 Å²	146.9	84%	0.842	78%	0.784	S	S	*	*			cis	-117.5	-162.8	14.3	-61.3	-88.7	0	0	0	111.5
669	Q	25.3	Very low	30.1	Very low	193 Å²	193	152.9 Å²	152.9	90%	0.902	79%	0.788	S	S	*	*			cis	-155.1	174.7	9.1	-159.8	173.5	-84.8	0	0	110.6
670	D	27.2	Very low	30.1	Very low	153 Å²	153	153.2 Å²	153.2	82%	0.818	79%	0.785	S	S	*	*			trans	-150.2	151.6	-170.5	-173.3	17.1	0	0	0	114
671	R	26.6	Very low	29.8	Very low	216 Å²	216	153 Å²	153	82%	0.815	78%	0.784	S	S	*	*			trans	139.7	134.8	173.7	-89.7	-168.1	179.3	-179.7	-0.9	110
672	D	22.4	Very low	28.2	Very low	134 Å²	134	157.9 Å²	157.9	72%	0.717	79%	0.794	S	S	*	*			cis	-143.3	178.9	19.6	-101.1	-47.1	0	0	0	114.3
673	H	26.3	Very low	27.9	Very low	175 Å²	175	162.4 Å²	162.4	81%	0.81	80%	0.796	S	S	*	*			trans	-66.4	176.2	178.2	-86.6	34.8	0	0	0	115.9
674	P	38.1	Very low	27.3	Very low	91 Å²	91	158.9 Å²	158.9	59%	0.591	80%	0.798	S	S	*	*			cis	-139	-178.5	-14.1	23.4	2	0	0	0	116.7
675	H	24.9	Very low	27.1	Very low	177 Å²	177	159.6 Å²	159.6	82%	0.819	80%	0.797	S	S	*	*			trans	94.8	149.9	152	-57.1	-54	0	0	0	121.8
676	R	26.8	Very low	26.8	Very low	242 Å²	242	164.1 Å²	164.1	91%	0.913	81%	0.808	S	S	*	*			trans	61.3	85.5	171.7	-74.5	-174.8	170.6	157.3	0.8	117.8
677	A	26.4	Very low	26.9	Very low	106 Å²	106	162.9 Å²	162.9	88%	0.876	81%	0.809	S	S	*	*			trans	-94.3	135.1	145.5	0	0	0	0	0	109.6
678	S	26.9	Very low	27.1	Very low	116 Å²	116	165.3 Å²	165.3	81%	0.811	82%	0.823	S	S	*	*			trans	-119.5	144.1	167.6	-66.3	0	0	0	0	108.9
679	K	27.1	Very low	27	Very low	202 Å²	202	164.8 Å²	164.8	88%	0.878	83%	0.828	S	S	*	*			trans	-148.2	156.6	163.3	-115.3	179.9	-179.8	-178.4	0	110.2
680	D	27.6	Very low	27.1	Very low	154 Å²	154	160.4 Å²	160.4	82%	0.824	83%	0.825	S	S	*	*			trans	-90.6	131.6	-150	-48.4	-92.5	0	0	0	114.5
681	M	26.7	Very low	27	Very low	170 Å²	170	165.1 Å²	165.1	84%	0.837	83%	0.831	S	S	*	*			trans	-166.1	115.7	144	-137.5	170.3	63.3	0	0	111.1
682	F	24.4	Very low	26.9	Very low	211 Å²	211	160.7 Å²	160.7	93%	0.925	83%	0.833	S	S	*	*			trans	-148.1	118	164.3	-95.7	-71.6	0	0	0	112.8
683	Y	25.9	Very low	26.9	Very low	210 Å²	210	159.5 Å²	159.5	82%	0.824	84%	0.836	S	S	*	*			trans	-70.7	158.2	158.4	-95.6	-113.3	0	0	0	110.3
684	V	24	Very low	27.1	Very low	142 Å²	142	157.5 Å²	157.5	86%	0.861	84%	0.838	S	S	*	*			trans	-132.9	131.4	159.9	-179.1	0	0	0	0	109
685	S	25.2	Very low	26.4	Very low	101 Å²	101	157.5 Å²	157.5	71%	0.706	85%	0.846	S	S	*	*			trans	-122.6	164.3	-177.9	-68.6	0	0	0	0	111.7
686	R	29	Very low	26.5	Very low	239 Å²	239	158.9 Å²	158.9	90%	0.902	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-71	152.7	-175.2	-56.9	174.2	176.4	178	-3.7	114.1
687	P	28.9	Very low	26.4	Very low	119 Å²	119	152.6 Å²	152.6	77%	0.773	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-90.6	163	146.1	-0.3	20.7	0	0	0	112.2
688	P	30.9	Very low	26.5	Very low	129 Å²	129	154.4 Å²	154.4	84%	0.838	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-92.2	171.3	-179.5	37.3	-35.7	0	0	0	114.2
689	L	26.7	Very low	26.4	Very low	180 Å²	180	154.1 Å²	154.1	94%	0.942	84%	0.835	S	S	*	*			trans	-108.3	135	173.6	-83.8	165.7	0	0	0	111.8
690	A	26.3	Very low	26.4	Very low	102 Å²	102	150.1 Å²	150.1	84%	0.843	83%	0.833	S	S	*	*			trans	-134	153.7	166	0	0	0	0	0	110.6
691	R	26.7	Very low	26.5	Very low	252 Å²	252	147.8 Å²	147.8	95%	0.951	83%	0.828	S	S	*	*			trans	-64.4	153.5	-165	-64.5	168.3	167.8	165.8	-6.8	115.1
692	S	23.3	Very low	26.4	Very low	123 Å²	123	146.7 Å²	146.7	86%	0.86	83%	0.826	S	S	*	*			trans	-135.4	153.1	146.1	60.4	0	0	0	0	111
693	S	23.5	Very low	26.5	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	82%	0.821	S	S	*	*			trans	-111.9	158.4	175.3	-70.8	0	0	0	0	109.6
694	P	29.8	Very low	26.5	Very low	133 Å²	133	139.6 Å²	139.6	86%	0.864	81%	0.814	S	S	*	*			trans	-72.4	146.6	-173.4	29.8	-36	0	0	0	112.5
695	A	23.8	Very low	26.6	Very low	91 Å²	91	140.7 Å²	140.7	75%	0.752	81%	0.81	S	S	*	*			trans	-137.5	139.4	169.8	0	0	0	0	0	110.4
696	Y	27.5	Very low	27.5	Very low	206 Å²	206	141.5 Å²	141.5	81%	0.808	81%	0.813	S	S	*	*			trans	-69.4	137.3	170	-80.7	-108	0	0	0	110.3
697	C	24.4	Very low	27.2	Very low	110 Å²	110	138.2 Å²	138.2	74%	0.743	81%	0.813	S	S	*	*			trans	-126.6	103.7	163	-80.7	0	0	0	0	110.4
698	T	28.8	Very low	27.1	Very low	144 Å²	144	136.2 Å²	136.2	88%	0.883	81%	0.807	S	S	*	*			trans	-80.7	132.8	149.2	50	0	0	0	0	108.2
699	S	24.6	Very low	26.9	Very low	109 Å²	109	140.2 Å²	140.2	76%	0.762	81%	0.811	S	S	*	*			trans	-149.9	120.6	166.5	55.3	0	0	0	0	111.3
700	S	26.8	Very low	26.9	Very low	118 Å²	118	136.1 Å²	136.1	83%	0.825	80%	0.804	S	S	*	*			trans	-94.7	164.9	159.2	-58.4	0	0	0	0	109.6
701	S	28.9	Very low	27	Very low	105 Å²	105	136.3 Å²	136.3	73%	0.734	80%	0.798	S	S	*	*			trans	-144.4	125.5	159.5	-55.8	0	0	0	0	104.6
702	D	25.3	Very low	26.9	Very low	148 Å²	148	131.6 Å²	131.6	79%	0.791	79%	0.791	S	S	*	*				62.2	129.2	79	-58.2	-44.1	0	0	0	111.4
703	I	26.7	Very low	27.1	Very low	160 Å²	160	130.5 Å²	130.5	82%	0.821	79%	0.789	S	S	*	*			cis	-149	176.3	20.5	-133.6	158.8	0	0	0	111.7
704	T	25.3	Very low	27.1	Very low	111 Å²	111	128.8 Å²	128.8	68%	0.681	79%	0.789	S	S	*	*			trans	-106	177.3	-164	70.4	0	0	0	0	114.3
705	E	26	Very low	26.9	Very low	166 Å²	166	131.6 Å²	131.6	78%	0.776	79%	0.793	S	S	*	*			cis	-144.6	-75.5	11	-147.6	147.2	-63.6	0	0	118.3
706	P	44.6	Very low	27	Very low	118 Å²	118	131 Å²	131	77%	0.766	80%	0.795	S	S	*	*			trans	-130.8	151.3	-130.6	39.8	-24.5	0	0	0	119.3
707	D	23.5	Very low	26.8	Very low	169 Å²	169	127.4 Å²	127.4	90%	0.904	80%	0.8	S	S	*	*				-155.8	167.6	125.8	-158.7	1.7	0	0	0	110.3
708	A	26.7	Very low	26.9	Very low	78 Å²	78	132.5 Å²	132.5	65%	0.645	81%	0.81	S	S	*	*			trans	-110	147.5	-158.4	0	0	0	0	0	116.7
709	K	26.2	Very low	26.7	Very low	213 Å²	213	128.9 Å²	128.9	93%	0.926	80%	0.802	S	S	*	*			trans	-165.4	144.9	134.8	-104.1	144.8	-170.2	164.7	0	112.8
710	A	27.2	Very low	26.7	Very low	94 Å²	94	127.5 Å²	127.5	78%	0.777	80%	0.804	S	S	*	*			trans	-81.3	177.3	174.7	0	0	0	0	0	110.9
711	S	26.6	Very low	26.8	Very low	105 Å²	105	130.3 Å²	130.3	73%	0.734	81%	0.809	S	S	*	*			cis	-168.5	174.7	5.2	-137	0	0	0	0	107.8
712	I	26.2	Very low	26.5	Very low	154 Å²	154	131.5 Å²	131.5	79%	0.79	82%	0.817	S	S	*	*			cis	-160	166.8	2.2	-161.7	162.6	0	0	0	109.8
713	A	26.5	Very low	26.6	Very low	99 Å²	99	130.4 Å²	130.4	82%	0.818	82%	0.822	S	S	*	*			trans	71.1	155.5	158.2	0	0	0	0	0	119.1
714	G	25	Very low	26.5	Very low	74 Å²	74	126.5 Å²	126.5	76%	0.763	82%	0.82	S	S	*	*			cis	177.4	148	-6.5	0	0	0	0	0	113.1
715	M	25	Very low	26.4	Very low	192 Å²	192	125.4 Å²	125.4	95%	0.946	83%	0.832	S	S	*	*			trans	-93.4	131.9	-169.6	-67.1	139.1	57.4	0	0	114.6
716	G	25.7	Very low	26.3	Very low	77 Å²	77	121.4 Å²	121.4	79%	0.794	83%	0.834	S	S	*	*				73.1	160.2	125	0	0	0	0	0	121
717	S	23.6	Very low	25.3	Very low	132 Å²	132	119.8 Å²	119.8	92%	0.923	84%	0.84	S	S	*	*			trans	-159.2	164.6	157.7	-138.3	0	0	0	0	111.6
718	F	25.4	Very low	25.3	Very low	216 Å²	216	115.2 Å²	115.2	95%	0.947	83%	0.832	S	S	*	*			trans	-151.3	151.8	-166.6	-175.5	-86	0	0	0	111.9
719	G	25.3	Very low	25.3	Very low	69 Å²	69	120 Å²	120	71%	0.711	85%	0.846	S	S	*	*			trans	105.8	162.4	177.3	0	0	0	0	0	113.9
720	G	24.7	Very low	25.2	Very low	79 Å²	79	113.5 Å²	113.5	81%	0.814	84%	0.84	S	S	*	*			cis	-167.1	177.3	1.4	0	0	0	0	0	113
721	L	27.9	Very low	25.1	Very low	177 Å²	177	115 Å²	115	93%	0.927	84%	0.844	S	S	*	*			trans	-80.2	153.3	-174	-63.2	161.6	0	0	0	113.8
722	S	24.3	Very low	25	Very low	130 Å²	130	113 Å²	113	91%	0.909	84%	0.84	S	S	*	*			trans	178.9	-178.1	133	45.4	0	0	0	0	112.4
723	S	26.5	Very low	25	Very low	126 Å²	126	113.1 Å²	113.1	88%	0.881	84%	0.841	S	S	*	*			trans	-138.3	144.7	-164.3	162.7	0	0	0	0	112.1
724	G	24.3	Very low	24.9	Very low	77 Å²	77	113 Å²	113	79%	0.794	84%	0.835	S	S	*	*			trans	176.2	159.1	171.8	0	0	0	0	0	112
725	G	23.5	Very low	24.9	Very low	89 Å²	89	115 Å²	115	92%	0.918	84%	0.837	S	S	*	*			trans	-168.8	166.7	178	0	0	0	0	0	114.8
726	G	24.3	Very low	24.9	Very low	81 Å²	81	113.7 Å²	113.7	84%	0.835	83%	0.829	S	S	*	*			trans	156.1	142	174.9	0	0	0	0	0	114
727	G	23.6	Very low	24.8	Very low	85 Å²	85	116.7 Å²	116.7	88%	0.876	83%	0.826	S	S	*	*			trans	76.6	150.1	179.9	0	0	0	0	0	114.4
728	G	23.4	Very low	24.8	Very low	72 Å²	72	121.4 Å²	121.4	74%	0.742	82%	0.824	S	S	*	*			cis	106.1	127.1	9.1	0	0	0	0	0	111.2
729	L	25.6	Very low	24.8	Very low	179 Å²	179	116 Å²	116	94%	0.937	82%	0.819	S	S	*	*			cis	-153.9	151.3	11.2	-74.6	165.9	0	0	0	112.6
730	G	24.7	Very low	24.7	Very low	77 Å²	77	117.1 Å²	117.1	79%	0.794	83%	0.83	S	S	*	*			trans	81.6	165	152	0	0	0	0	0	118.8
731	S	24.7	Very low	24.7	Very low	125 Å²	125	116.6 Å²	116.6	87%	0.874	83%	0.825	S	S	*	*			cis	-165.5	159.2	-21.6	-158.6	0	0	0	0	111.2
732	G	25.4	Very low	24.7	Very low	63 Å²	63	116.6 Å²	116.6	65%	0.649	81%	0.812	S	S	*	*			trans	118.2	89.7	175.8	0	0	0	0	0	113.7
733	L	25.4	Very low	24.9	Very low	156 Å²	156	115.8 Å²	115.8	82%	0.817	80%	0.797	S	S	*	*				66	92.9	73.9	-59	177.4	0	0	0	112.6
734	S	23.7	Very low	25	Very low	97 Å²	97	115 Å²	115	68%	0.678	79%	0.792	S	S	*	*				74.6	121	84.5	71.5	0	0	0	0	114
735	S	26.4	Very low	25	Very low	117 Å²	117	116 Å²	116	82%	0.818	79%	0.793	S	S	*	*				163.4	-171.1	84.3	50.6	0	0	0	0	109.5
736	Q	24	Very low	25.1	Very low	164 Å²	164	115.7 Å²	115.7	77%	0.766	79%	0.789	S	S	*	*				-170.5	161.3	-61.3	-158.7	-172.2	24.1	0	0	108.3
737	L	25	Very low	25.2	Very low	140 Å²	140	118 Å²	118	73%	0.733	79%	0.792	S	S	*	*			trans	70.5	179.6	163.7	-51.3	179.5	0	0	0	118.5
738	R	23.1	Very low	25.2	Very low	231 Å²	231	117.7 Å²	117.7	87%	0.872	79%	0.789	S	S	*	*				-166.1	130.7	-71.2	-133.6	-178.9	-171.1	-173.9	3.9	113.6
739	A	25.7	Very low	25.4	Very low	103 Å²	103	117.9 Å²	117.9	85%	0.851	79%	0.792	S	S	*	*			trans	58.8	125	147.2	0	0	0	0	0	126.4
740	G	23	Very low	25.3	Very low	91 Å²	91	115.1 Å²	115.1	94%	0.938	79%	0.787	S	S	*	*				111.2	118.8	111.7	0	0	0	0	0	124.6
741	G	23.7	Very low	25.4	Very low	69 Å²	69	117 Å²	117	71%	0.711	79%	0.789	S	S	*	*			trans	170.1	155.6	163.7	0	0	0	0	0	112.7
742	R	27.8	Very low	25.4	Very low	176 Å²	176	119.6 Å²	119.6	66%	0.664	79%	0.789	S	S	*	*			cis	87.1	132.5	-4.3	-68.7	-171.2	176	-85.7	-11.3	119.2
743	L	28.2	Very low	25.4	Very low	113 Å²	113	122.8 Å²	122.8	59%	0.592	80%	0.801	S	S	*	*			cis	-152.6	151.4	-0.9	-95.3	170	0	0	0	108.8
744	S	29.1	Very low	25.3	Very low	111 Å²	111	119.2 Å²	119.2	78%	0.776	80%	0.802	S	S	*	*				89.1	127.3	60.5	-170.7	0	0	0	0	117.8
745	A	25.8	Very low	25.4	Very low	97 Å²	97	118.5 Å²	118.5	80%	0.802	81%	0.81	S	S	*	*			trans	-162.9	130.4	164.3	0	0	0	0	0	115.3
746	G	24.2	Very low	25.6	Very low	82 Å²	82	121.1 Å²	121.1	85%	0.845	81%	0.814	S	S	*	*			trans	68.2	156	155.3	0	0	0	0	0	120.8
747	S	26	Very low	25.7	Very low	129 Å²	129	125.8 Å²	125.8	90%	0.902	82%	0.824	S	S	*	*			cis	-164.4	152.4	-20.8	-166.1	0	0	0	0	111.2
748	G	24.2	Very low	25.6	Very low	79 Å²	79	126.5 Å²	126.5	81%	0.814	83%	0.828	S	S	*	*			trans	74.7	159.3	174.1	0	0	0	0	0	115.9
749	G	27.2	Very low	25.7	Very low	77 Å²	77	119.6 Å²	119.6	79%	0.794	82%	0.815	S	S	*	*			cis	154	123.8	-4.5	0	0	0	0	0	110.7
750	S	24.4	Very low	25.7	Very low	120 Å²	120	123 Å²	123	84%	0.839	81%	0.814	S	S	*	*			trans	-132	130.8	-173.1	-50.6	0	0	0	0	112.8
751	S	25.7	Very low	25.8	Very low	118 Å²	118	126.6 Å²	126.6	83%	0.825	81%	0.81	S	S	*	*			trans	178.3	119	136.8	-82.6	0	0	0	0	114.9
752	M	25.4	Very low	25.9	Very low	179 Å²	179	128 Å²	128	88%	0.882	81%	0.809	S	S	*	*			trans	15.1	121.4	140.7	-47.1	-51.9	172.9	0	0	121.6
753	S	26.1	Very low	26	Very low	129 Å²	129	127.6 Å²	127.6	90%	0.902	82%	0.815	S	S	*	*			trans	-173.2	151	131	-78.6	0	0	0	0	108.7
754	G	23.5	Very low	25.8	Very low	82 Å²	82	130 Å²	130	85%	0.845	83%	0.826	S	S	*	*			cis	136	83.6	-0.8	0	0	0	0	0	112.1
755	G	25.3	Very low	25.7	Very low	81 Å²	81	128 Å²	128	84%	0.835	82%	0.821	S	S	*	*			trans	-179.3	136.2	177.6	0	0	0	0	0	115.1
756	L	30.6	Very low	25.7	Very low	173 Å²	173	129.5 Å²	129.5	91%	0.906	82%	0.821	S	S	*	*			trans	-122.1	136.6	175.1	-71.7	167	0	0	0	109.7
757	R	25.4	Very low	25.8	Very low	261 Å²	261	132 Å²	132	99%	0.985	82%	0.82	S	S	*	*			trans	-167.2	-176.6	148.7	-110.3	164.1	-169.6	-163.6	0.8	112.5
758	L	24.1	Very low	25.9	Very low	156 Å²	156	131.7 Å²	131.7	82%	0.817	81%	0.813	S	S	*	*			trans	-141.1	142.4	-135.8	-171.4	69.6	0	0	0	114.3
759	S	24.9	Very low	26	Very low	85 Å²	85	134.2 Å²	134.2	59%	0.594	81%	0.808	S	S	*	*			trans	66.5	158.4	150.4	60.7	0	0	0	0	123.9
760	Q	25	Very low	25.9	Very low	175 Å²	175	135.3 Å²	135.3	82%	0.818	80%	0.803	S	S	*	*			trans	74.9	127.7	162.7	-68	158.5	-65.5	0	0	116.8
761	L	25.5	Very low	26	Very low	166 Å²	166	137.4 Å²	137.4	87%	0.869	80%	0.804	S	S	*	*				-147.1	-173.8	57.6	-150.1	66.2	0	0	0	114
762	S	25.5	Very low	26.1	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	80%	0.797	S	S	*	*			trans	-158.9	155.1	-171.1	54.9	0	0	0	0	114.7
763	Q	29.2	Very low	26.6	Very low	167 Å²	167	137 Å²	137	78%	0.78	80%	0.798	S	S	*	*			trans	144.7	151	141.8	-80.3	-175.9	2.1	0	0	115.5
764	M	24.6	Very low	26.9	Very low	165 Å²	165	139.8 Å²	139.8	81%	0.813	80%	0.797	S	S	*	*			trans	29.1	145	159.7	-77.9	60.5	150.8	0	0	121.3
765	G	26.2	Very low	27.5	Very low	67 Å²	67	144.1 Å²	144.1	69%	0.691	80%	0.795	S	S	*	*			cis	141.9	173.3	4.2	0	0	0	0	0	111
766	T	26	Very low	28	Very low	130 Å²	130	147.8 Å²	147.8	80%	0.798	79%	0.79	S	S	*	*			cis	-178.3	119.2	-15.2	16.1	0	0	0	0	108.8
767	T	28.1	Very low	28	Very low	135 Å²	135	148.8 Å²	148.8	83%	0.828	79%	0.79	S	S	*	*			trans	-146	131.8	172.2	52.2	0	0	0	0	115
768	T	27.5	Very low	28.3	Very low	121 Å²	121	143.8 Å²	143.8	74%	0.742	78%	0.778	S	S	*	*			trans	-18.2	152.8	153.1	51.7	0	0	0	0	119.1
769	D	26	Very low	28.6	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	77%	0.773	S	S	*	*			cis	-157.7	160.8	5.5	-132.8	-54.4	0	0	0	116.2
770	S	25.3	Very low	28.8	Very low	100 Å²	100	141 Å²	141	70%	0.699	78%	0.783	S	S	*	*			trans	38	110.7	148.6	-70.8	0	0	0	0	122.7
771	L	26.4	Very low	29.1	Very low	164 Å²	164	136.7 Å²	136.7	86%	0.859	78%	0.777	S	S	*	*				-163.1	129.5	127.9	-111.7	166.1	0	0	0	113.7
772	S	28.2	Very low	29.2	Very low	97 Å²	97	136.8 Å²	136.8	68%	0.678	78%	0.775	S	S	*	*			trans	38.6	81.5	161.4	60.6	0	0	0	0	119.8	Q774	S772-Q774 PolarHBondContact O-N 3.06Å
773	Q	34.2	Very low	29.4	Very low	193 Å²	193	142.9 Å²	142.9	90%	0.902	78%	0.783	S	S	*	*			trans	-77.6	54.9	169.1	-163.5	177.6	68.4	0	0	113.2
774	Q	33.3	Very low	29.2	Very low	187 Å²	187	145.5 Å²	145.5	87%	0.874	79%	0.787	S	S	*	*			trans	-115.4	4.5	179.3	-157.6	173.3	-7.5	0	0	114	S772	S772-Q774 PolarHBondContact O-N 3.06Å
775	Q	36.4	Very low	29.3	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	78%	0.775	S	S	*	*	S	Bend	trans	-125.7	32	-173.5	-152.9	169.7	5.9	0	0	114.5
776	Q	35.3	Very low	29.3	Very low	159 Å²	159	146.4 Å²	146.4	74%	0.743	78%	0.783	S	S	*	*	S	Bend	trans	-131	10.5	180	-127	171.2	4.7	0	0	116.4
777	H	31.5	Very low	29.2	Very low	193 Å²	193	144.8 Å²	144.8	89%	0.894	78%	0.777	S	S	*	*	S	Bend	trans	-99	-3.2	168.5	-92.7	85.8	0	0	0	114.5
778	Q	31.9	Very low	29.2	Very low	157 Å²	157	147.4 Å²	147.4	73%	0.734	78%	0.777	S	S	*	*	S	Bend	trans	-89	-13.8	174.6	-74.8	179.2	-26.6	0	0	113.9	A780	Q778-A780 VanDerWaalsContact C-N 3.33Å; Q778-A780 PolarHBondContact O-N 3.17Å
779	A	29.5	Very low	29.1	Very low	86 Å²	86	149.7 Å²	149.7	71%	0.711	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-9.5	-172.6	0	0	0	0	0	115.3
780	A	29.9	Very low	29.2	Very low	97 Å²	97	148.3 Å²	148.3	80%	0.802	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-8.9	-177.4	0	0	0	0	0	114.5	Q778	Q778-A780 VanDerWaalsContact C-N 3.33Å; Q778-A780 PolarHBondContact O-N 3.17Å
781	A	30	Very low	29.2	Very low	84 Å²	84	149.5 Å²	149.5	69%	0.694	78%	0.778	S	S	*	*	S	Bend	trans	-94.7	-11.5	-170.5	0	0	0	0	0	115.1	R783	A781-R783 PolarHBondContact O-N 3.19Å
782	M	28.3	Very low	29.3	Very low	168 Å²	168	147 Å²	147	83%	0.828	76%	0.764	S	S	*	*			trans	-97.3	51.1	-167.9	-67	-65.2	-72.2	0	0	113.6
783	R	28.6	Very low	29.6	Very low	227 Å²	227	148.7 Å²	148.7	86%	0.857	76%	0.76	S	S	*	*			trans	-132.2	21.9	-174.8	-88.3	-75.6	-175	156.3	0.6	116.1	A781	A781-R783 PolarHBondContact O-N 3.19Å
784	Y	25.9	Very low	29.3	Very low	221 Å²	221	148.2 Å²	148.2	87%	0.867	76%	0.757	S	S	*	*			trans	-143.5	126.2	163.1	-85.5	-76.7	0	0	0	111.3
785	P	26.5	Very low	28.9	Very low	87 Å²	87	146.8 Å²	146.8	57%	0.565	76%	0.755	S	S	*	*			trans	-78.9	145.7	173.8	31.9	-33.5	0	0	0	111.7	S787	P785-S787 PolarHBondContact O-N 3.41Å; P785-S787 VanDerWaalsContact O-N 3.13Å
786	L	25.6	Very low	28.4	Very low	164 Å²	164	142.7 Å²	142.7	86%	0.859	75%	0.75	S	S	*	*			trans	-69.9	102.5	-172.4	-68.6	162.2	0	0	0	112.9
787	S	24.6	Very low	28	Very low	97 Å²	97	141.6 Å²	141.6	68%	0.678	76%	0.755	S	S	*	*			trans	-81.9	122.3	157.9	48.9	0	0	0	0	109.6	P785 Q789	P785-S787 PolarHBondContact O-N 3.41Å; P785-S787 VanDerWaalsContact O-N 3.13Å; S787-Q789 PolarHBondContact O-N 3.28Å
788	F	27.6	Very low	27.7	Very low	190 Å²	190	136.8 Å²	136.8	83%	0.833	75%	0.748	S	S	*	*			trans	-68.7	105.8	172.6	-91.4	-87.1	0	0	0	109.6
789	Q	26	Very low	27.4	Very low	169 Å²	169	137 Å²	137	79%	0.79	75%	0.754	S	S	*	*			trans	-89.1	122.2	-170.1	-159	162.6	4	0	0	110.6	S787	S787-Q789 PolarHBondContact O-N 3.28Å
790	N	29	Very low	27.1	Very low	103 Å²	103	136 Å²	136	55%	0.551	75%	0.752	S	S	*	*			trans	-66.6	120.7	-176.9	-176.7	-18	0	0	0	110.6	L792	N790-L792 PolarHBondContact O-N 3.32Å; N790-L792 VanDerWaalsContact O-N 3.09Å; N790-L792 PolarHBondContact OD1-N 3.21Å
791	P	25.2	Very low	27	Very low	125 Å²	125	137.9 Å²	137.9	81%	0.812	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	3.1	-167.3	30.1	-37.1	0	0	0	115.6	F793	P791-F793 VanDerWaalsContact C-N 3.26Å; P791-F793 PolarHBondContact O-N 3.33Å
792	L	28.7	Very low	26.8	Very low	111 Å²	111	143 Å²	143	58%	0.581	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-9.8	-176.4	-84.9	168	0	0	0	115.5	N790	N790-L792 PolarHBondContact O-N 3.32Å; N790-L792 VanDerWaalsContact O-N 3.09Å; N790-L792 PolarHBondContact OD1-N 3.21Å
793	F	33.3	Very low	26.5	Very low	132 Å²	132	143.8 Å²	143.8	58%	0.579	77%	0.768	S	S	*	*	S	Bend	trans	-131.6	78.6	-177.6	-79	-107.8	0	0	0	112.7	P791	P791-F793 VanDerWaalsContact C-N 3.26Å; P791-F793 PolarHBondContact O-N 3.33Å
794	H	27.7	Very low	26.4	Very low	184 Å²	184	142.2 Å²	142.2	85%	0.852	77%	0.77	S	S	*	*			trans	-177.1	89.3	141	-101.7	-70.5	0	0	0	110.3
795	L	25.7	Very low	26.3	Very low	157 Å²	157	138.7 Å²	138.7	82%	0.822	77%	0.766	S	S	*	*			trans	-166.6	88.7	162.9	-115.3	171.7	0	0	0	111.7
796	A	25.3	Very low	26.3	Very low	86 Å²	86	143.6 Å²	143.6	71%	0.711	78%	0.781	S	S	*	*			trans	-168.2	143	158.1	0	0	0	0	0	110
797	T	26.7	Very low	26.3	Very low	136 Å²	136	143.2 Å²	143.2	83%	0.834	77%	0.774	S	S	*	*			trans	53.7	74.9	163.7	60.8	0	0	0	0	118.9
798	A	26	Very low	26.3	Very low	91 Å²	91	147.4 Å²	147.4	75%	0.752	78%	0.783	S	S	*	*				-105.7	149.9	95.1	0	0	0	0	0	106.5
799	D	25.3	Very low	26.2	Very low	161 Å²	161	146.8 Å²	146.8	86%	0.861	78%	0.782	S	S	*	*			cis	-118.1	170.3	14.6	-73.6	-59.2	0	0	0	114.6
800	G	23.3	Very low	26.2	Very low	65 Å²	65	144.1 Å²	144.1	67%	0.67	78%	0.782	S	S	*	*			trans	179.2	97.7	169.3	0	0	0	0	0	110.9	Q802	G800-Q802 PolarHBondContact O-N 3.02Å
801	P	27.8	Very low	26.1	Very low	137 Å²	137	150.7 Å²	150.7	89%	0.89	80%	0.799	S	S	*	*			trans	-77.3	127.5	-169.8	29.7	-34.2	0	0	0	111.8
802	Q	24.8	Very low	26.2	Very low	192 Å²	192	149.5 Å²	149.5	90%	0.897	80%	0.8	S	S	*	*			trans	-120.9	126	171.1	-154.4	169.6	17.6	0	0	110.8	G800	G800-Q802 PolarHBondContact O-N 3.02Å
803	Q	23.8	Very low	26.1	Very low	184 Å²	184	152.6 Å²	152.6	86%	0.86	81%	0.812	S	S	*	*			trans	-70.8	139.5	-174.5	-63.4	160.5	-26.6	0	0	111.2
804	Q	25.9	Very low	26.3	Very low	194 Å²	194	151.8 Å²	151.8	91%	0.907	82%	0.82	S	S	*	*			trans	-117.8	124.3	156.2	-78.2	-165.7	-22.9	0	0	110
805	L	23.7	Very low	26.6	Very low	148 Å²	148	148.7 Å²	148.7	78%	0.775	82%	0.816	S	S	*	*			trans	-81	126.2	173.5	-83.6	138.9	0	0	0	110.2
806	H	26.3	Very low	26.7	Very low	190 Å²	190	145.5 Å²	145.5	88%	0.88	81%	0.812	S	S	*	*			trans	-140.1	139.8	148.8	-125.4	61.5	0	0	0	110.9
807	H	25.4	Very low	27.6	Very low	155 Å²	155	146.6 Å²	146.6	72%	0.718	81%	0.812	S	S	*	*			trans	-82.3	138.9	177	-68.5	-3.5	0	0	0	110.5
808	Q	24.8	Very low	27.6	Very low	186 Å²	186	147.4 Å²	147.4	87%	0.869	81%	0.81	S	S	*	*				-173.7	165.9	102.1	-95.5	179.5	23.2	0	0	111.9
809	H	26.1	Very low	27.8	Very low	176 Å²	176	150.9 Å²	150.9	82%	0.815	82%	0.815	S	S	*	*			trans	-74.6	148.3	-170.5	-53.6	-101	0	0	0	112
810	S	25.4	Very low	27.9	Very low	114 Å²	114	150.6 Å²	150.6	80%	0.797	81%	0.813	S	S	*	*				-179.1	133.1	79.3	-71.2	0	0	0	0	116.1
811	R	26.5	Very low	28.3	Very low	240 Å²	240	151.6 Å²	151.6	91%	0.906	82%	0.815	S	S	*	*				73.2	110.7	129.1	-167.7	169.6	179.5	157.1	0.2	122.9
812	A	28.2	Very low	28.8	Very low	100 Å²	100	150.9 Å²	150.9	83%	0.826	81%	0.811	S	S	*	*			trans	94.3	143.7	137.4	0	0	0	0	0	122.4
813	Q	26	Very low	29.1	Very low	176 Å²	176	148.8 Å²	148.8	82%	0.822	81%	0.805	S	S	*	*			trans	-122.2	171.4	178.8	-139.5	-176.5	18.3	0	0	108.1
814	P	36.7	Very low	29.8	Very low	115 Å²	115	145.9 Å²	145.9	75%	0.747	80%	0.803	S	S	*	*				-147.6	-139.2	76.6	36.7	-10.7	0	0	0	114.3
815	P	34.8	Very low	29.9	Very low	120 Å²	120	144.4 Å²	144.4	78%	0.779	80%	0.796	S	S	*	*				-126.7	-169.4	-112.6	41.5	-21	0	0	0	117.3
816	A	28.3	Very low	30.8	Very low	89 Å²	89	142.1 Å²	142.1	74%	0.736	79%	0.79	S	S	*	*			trans	-118.3	-151.6	174.3	0	0	0	0	0	110.8
817	P	42.8	Very low	30.9	Very low	109 Å²	109	136.8 Å²	136.8	71%	0.708	77%	0.774	S	S	*	*			cis	-144.9	-161.9	11.9	33.9	-6	0	0	0	117.2
818	L	28	Very low	31.2	Very low	154 Å²	154	137.4 Å²	137.4	81%	0.806	78%	0.777	S	S	*	*			trans	82.3	135.8	161	-50.3	173.7	0	0	0	121.3
819	L	29.4	Very low	31.4	Very low	163 Å²	163	137.6 Å²	137.6	85%	0.853	78%	0.777	S	S	*	*				173.2	178.9	103.3	-100.1	178.4	0	0	0	117.3
820	L	28.7	Very low	31.7	Very low	155 Å²	155	133.4 Å²	133.4	81%	0.812	77%	0.773	S	S	*	*			trans	-67.6	168.6	-170.9	-104.1	64.1	0	0	0	119
821	A	32	Very low	32	Very low	86 Å²	86	138 Å²	138	71%	0.711	78%	0.775	S	S	*	*			trans	-99.1	156.7	146.9	0	0	0	0	0	110.2
822	P	37.9	Very low	33	Very low	123 Å²	123	133.6 Å²	133.6	80%	0.799	77%	0.767	S	S	*	*				-155.8	-175.4	96.3	42	-22.9	0	0	0	116.8
823	D	31.2	Very low	34.3	Very low	147 Å²	147	133.8 Å²	133.8	79%	0.786	76%	0.76	S	S	*	*			trans	-59.3	159.8	165.4	-108.4	-55.7	0	0	0	114.4
824	P	38.8	Very low	34.7	Very low	124 Å²	124	133 Å²	133	81%	0.805	76%	0.757	S	S	*	*				-154.5	164.4	88.2	40.9	-21.3	0	0	0	120
825	E	27.1	Very low	34.5	Very low	162 Å²	162	136.4 Å²	136.4	76%	0.757	76%	0.76	S	S	*	*			trans	-78.5	-175.2	166.5	-119.7	-138.7	122.7	0	0	112.8	S827	E825-S827 PolarHBondContact OE1-N 3.34Å
826	P	41.9	Very low	34.3	Very low	100 Å²	100	134.2 Å²	134.2	65%	0.649	75%	0.752	S	S	*	*			cis	-146.1	171.8	21.7	41.3	-19.4	0	0	0	121.3
827	S	29.1	Very low	34.5	Very low	78 Å²	78	139.6 Å²	139.6	55%	0.545	76%	0.762	S	S	.	*			trans	76.9	101.9	139.4	62.6	0	0	0	0	125.3	E825	E825-S827 PolarHBondContact OE1-N 3.34Å
828	H	31.6	Very low	33.9	Very low	169 Å²	169	138.3 Å²	138.3	78%	0.782	77%	0.769	S	S	*	*				77.2	121.2	123.9	-62.7	-46.9	0	0	0	127.3
829	Q	29.7	Very low	34	Very low	189 Å²	189	134.5 Å²	134.5	88%	0.883	77%	0.767	S	S	*	*			trans	69.4	131.9	145.9	-65.6	-177.6	-0.3	0	0	120.1
830	A	31.9	Very low	34.1	Very low	88 Å²	88	136.4 Å²	136.4	73%	0.727	77%	0.768	S	S	*	*			cis	-160.4	168.4	-6.8	0	0	0	0	0	113
831	Y	31.1	Very low	34.3	Very low	211 Å²	211	133.8 Å²	133.8	83%	0.827	76%	0.763	S	S	*	*			trans	74.3	86.4	169.6	-96.6	-93.6	0	0	0	121
832	I	47.7	Very low	34.2	Very low	147 Å²	147	141 Å²	141	75%	0.754	77%	0.772	S	S	*	*				63.2	157.5	125.4	-69.4	169.5	0	0	0	119.7
833	P	56	Low	34	Very low	104 Å²	104	139 Å²	139	68%	0.675	76%	0.761	S	S	*	*			cis	-133.4	-175.7	-0.9	40.1	-20	0	0	0	118.7
834	Q	34.2	Very low	34.2	Very low	160 Å²	160	140.1 Å²	140.1	75%	0.748	76%	0.762	S	S	*	*			trans	68.5	133.9	139.6	-89.7	180	-28.4	0	0	127.2
835	F	32.5	Very low	33.8	Very low	186 Å²	186	140.1 Å²	140.1	82%	0.816	76%	0.755	S	S	*	*			trans	68.9	132.1	138.6	-89.2	-58.3	0	0	0	127.2
836	A	30.8	Very low	34.1	Very low	75 Å²	75	139.3 Å²	139.3	62%	0.62	76%	0.755	S	S	*	*				114.7	142.9	127.3	0	0	0	0	0	124
837	H	32.2	Very low	33.5	Very low	201 Å²	201	138.5 Å²	138.5	93%	0.931	75%	0.751	S	S	*	*			trans	59.2	162.2	158.3	-62.1	-59.6	0	0	0	123.2
838	G	30.2	Very low	33.5	Very low	83 Å²	83	140.7 Å²	140.7	86%	0.856	76%	0.762	S	S	*	*			trans	-166.6	-174.4	-178.1	0	0	0	0	0	116.1
839	G	30.1	Very low	33.2	Very low	74 Å²	74	139.1 Å²	139.1	76%	0.763	76%	0.759	S	S	*	*			trans	157	154.5	171.4	0	0	0	0	0	119.3
840	F	31.6	Very low	32.9	Very low	202 Å²	202	140.6 Å²	140.6	89%	0.886	76%	0.756	S	S	*	*			trans	57.1	130.7	153.3	-73.2	-77.3	0	0	0	127.1
841	S	32.3	Very low	32.6	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	76%	0.761	S	S	*	*				77.2	115.4	129.3	-70.3	0	0	0	0	128.1
842	R	30.6	Very low	32.2	Very low	236 Å²	236	142.7 Å²	142.7	89%	0.891	76%	0.759	S	S	*	*				70.9	129.5	121.7	-89.1	-175.3	167.8	175	-4.6	127.5
843	S	33.6	Very low	31.1	Very low	83 Å²	83	141.9 Å²	141.9	58%	0.58	76%	0.756	S	S	*	*				82.8	132	128.2	-86.1	0	0	0	0	126.1
844	E	34.7	Very low	29.7	Very low	170 Å²	170	140.2 Å²	140.2	79%	0.794	76%	0.758	S	S	*	*			trans	58.6	148.7	130.3	-76.2	155.5	139.4	0	0	122.2
845	D	30.9	Very low	29.4	Very low	124 Å²	124	140.7 Å²	140.7	66%	0.663	76%	0.76	S	S	*	*			cis	-165.8	169.1	-14	-150.7	2.3	0	0	0	113.1
846	L	33.6	Very low	29.1	Very low	145 Å²	145	139.7 Å²	139.7	76%	0.759	76%	0.762	S	S	*	*			trans	39.3	154.2	148	-78.9	171.9	0	0	0	123
847	S	29.9	Very low	28.9	Very low	82 Å²	82	140 Å²	140	57%	0.573	77%	0.773	S	S	*	*			cis	-175.3	159.7	10	41.9	0	0	0	0	115
848	T	28.3	Very low	28.6	Very low	125 Å²	125	139.3 Å²	139.3	77%	0.767	77%	0.77	S	S	*	*			trans	67.5	160.6	146.8	51.3	0	0	0	0	120.9
849	L	24.4	Very low	29.1	Very low	136 Å²	136	140.2 Å²	140.2	71%	0.712	76%	0.761	S	S	*	*			cis	-156.2	136.5	0.6	-124.1	161.9	0	0	0	112.5
850	R	25.2	Very low	28.8	Very low	219 Å²	219	140.7 Å²	140.7	83%	0.826	75%	0.753	S	S	*	*			trans	26.6	167.1	148.5	-75.9	178	-178.2	-171	0.4	124.5
851	T	24	Very low	28.6	Very low	136 Å²	136	138.1 Å²	138.1	83%	0.834	75%	0.747	S	S	*	*			trans	86.7	147	161.3	72	0	0	0	0	115.7
852	R	23.9	Very low	28.2	Very low	208 Å²	208	140.2 Å²	140.2	79%	0.785	75%	0.748	S	S	*	*			cis	-169.8	163.5	-14.8	162.8	175.7	178.7	-161.7	-8.8	109
853	D	24.4	Very low	27.9	Very low	130 Å²	130	136.9 Å²	136.9	70%	0.695	74%	0.742	S	S	*	*			trans	12.1	141.1	164.3	-47	-19.9	0	0	0	120.8
854	G	25.9	Very low	27.4	Very low	69 Å²	69	136.4 Å²	136.4	71%	0.711	74%	0.739	S	S	*	*			trans	143.2	84.7	144.4	0	0	0	0	0	119.7
855	H	27.6	Very low	27.1	Very low	169 Å²	169	136.6 Å²	136.6	78%	0.782	74%	0.74	S	S	*	*			trans	31.5	128.2	137.1	-80.5	-98.7	0	0	0	123.4
856	L	27.4	Very low	26.8	Very low	165 Å²	165	134.7 Å²	134.7	86%	0.864	74%	0.736	S	S	*	*			trans	65	117.5	135.2	-60.9	168.8	0	0	0	119.9
857	G	25.5	Very low	26.4	Very low	83 Å²	83	137.8 Å²	137.8	86%	0.856	74%	0.739	S	S	*	*			trans	177.8	65.9	171.9	0	0	0	0	0	115.6
858	Q	25.7	Very low	26.2	Very low	185 Å²	185	137.8 Å²	137.8	86%	0.864	74%	0.739	S	S	*	*			trans	-86	168.1	157.3	-97	-152.7	15	0	0	109.4
859	P	41.8	Very low	26.2	Very low	102 Å²	102	138.8 Å²	138.8	66%	0.662	74%	0.74	S	S	*	*			cis	-144.3	-170.9	22.1	31.9	-6.1	0	0	0	117.6
860	S	24.8	Very low	26.3	Very low	85 Å²	85	138 Å²	138	59%	0.594	74%	0.736	S	S	*	*				87	113.2	129.2	53.2	0	0	0	0	126.5
861	I	25.6	Very low	26.3	Very low	148 Å²	148	137 Å²	137	76%	0.759	73%	0.734	S	S	*	*				82.7	159.7	121.8	-57.7	164.9	0	0	0	119.6
862	I	24.7	Very low	26.5	Very low	145 Å²	145	135 Å²	135	74%	0.744	73%	0.726	S	S	*	*			trans	89.4	91.4	175.3	-51.6	-171.5	0	0	0	113.3
863	H	24.3	Very low	26.7	Very low	165 Å²	165	134.4 Å²	134.4	76%	0.764	72%	0.723	S	S	*	*				83.1	145.7	78.3	-74.7	12.9	0	0	0	113.4
864	S	23.8	Very low	26.9	Very low	74 Å²	74	131.8 Å²	131.8	52%	0.517	72%	0.72	S	S	.	*			cis	-173.9	177.5	-14.6	46.4	0	0	0	0	110.4
865	H	27.9	Very low	27	Very low	174 Å²	174	132.9 Å²	132.9	81%	0.806	71%	0.709	S	S	*	*			trans	77.2	154	162.3	-56.7	-55.5	0	0	0	119.4
866	S	23.2	Very low	27	Very low	83 Å²	83	135.1 Å²	135.1	58%	0.58	71%	0.712	S	S	*	*			cis	-172.7	166.9	-27.2	-169.3	0	0	0	0	110.3
867	Y	25.9	Very low	27.1	Very low	211 Å²	211	130.7 Å²	130.7	83%	0.827	71%	0.706	S	S	*	*			trans	71.3	150.4	171.9	-64.5	-85.9	0	0	0	117
868	S	26.6	Very low	27.2	Very low	81 Å²	81	136.4 Å²	136.4	57%	0.566	70%	0.702	S	S	*	*			cis	159.4	165.1	-28.9	-90.3	0	0	0	0	107.5
869	D	28.2	Very low	27.4	Very low	147 Å²	147	136.4 Å²	136.4	79%	0.786	69%	0.694	S	S	*	*			cis	-166.1	-159.6	-43	-72.7	-45.1	0	0	0	103.2
870	D	27.1	Very low	26.6	Very low	118 Å²	118	137.6 Å²	137.6	63%	0.631	69%	0.691	S	S	*	*			cis	-160.1	176.5	-6.7	-168.5	-1	0	0	0	106.3
871	Y	24.8	Very low	26.7	Very low	198 Å²	198	140.1 Å²	140.1	78%	0.776	70%	0.696	S	S	*	*			trans	68.5	142.5	169.6	-65.3	-80	0	0	0	118.3
872	S	27.1	Very low	26.7	Very low	95 Å²	95	138.1 Å²	138.1	66%	0.664	70%	0.696	S	S	*	*			cis	-178.4	172.3	-18.6	-129.8	0	0	0	0	107.1
873	R	29.4	Very low	26.8	Very low	196 Å²	196	138.4 Å²	138.4	74%	0.74	70%	0.696	S	S	*	*			cis	-161.5	-167.6	-6.6	-143.3	-163.9	152	95.7	5.1	105.6	D875	R873-D875 IonicContact CZ-OD2 3.5Å; R873-D875 IonicContact NE-OD2 3.49Å; R873-D875 PolarHBondContact NE-OD2 2.9Å; R873-D875 IonicContact NH2-OD1 2.71Å; R873-D875 IonicContact NH2-OD2 2.94Å; R873-D875 PolarHBondContact NH2-OD2 3.39Å
874	A	27.4	Very low	27	Very low	75 Å²	75	137.2 Å²	137.2	62%	0.62	69%	0.69	S	S	*	*			cis	-158.6	157.7	1.4	0	0	0	0	0	113.3
875	D	28	Very low	27.2	Very low	91 Å²	91	138 Å²	138	49%	0.487	69%	0.686	S	S	.	*			trans	8.1	152.5	135.1	-40.4	-57.8	0	0	0	121.6	R873	R873-D875 IonicContact CZ-OD2 3.5Å; R873-D875 IonicContact NE-OD2 3.49Å; R873-D875 PolarHBondContact NE-OD2 2.9Å; R873-D875 IonicContact NH2-OD1 2.71Å; R873-D875 IonicContact NH2-OD2 2.94Å; R873-D875 PolarHBondContact NH2-OD2 3.39Å
876	Y	27.6	Very low	27.2	Very low	216 Å²	216	131.7 Å²	131.7	85%	0.847	66%	0.658	S	S	*	*			cis	-155.4	139	27	-111.4	-65	0	0	0	115.5
877	G	30	Very low	27.4	Very low	72 Å²	72	129.7 Å²	129.7	74%	0.742	64%	0.64	S	S	*	*			trans	75.6	164.9	133.2	0	0	0	0	0	123.1
878	R	28.1	Very low	27.5	Very low	204 Å²	204	121.2 Å²	121.2	77%	0.77	61%	0.609	S	S	*	*			cis	-174.3	113.2	-14.1	-173.7	-175.7	-156.2	-97.2	5.5	115.3
879	R	29.9	Very low	27.7	Very low	185 Å²	185	122.1 Å²	122.1	70%	0.698	61%	0.607	S	S	*	*			trans	63	168.5	149.8	-63.9	171.3	-179.8	-111.8	3.5	118.5
880	Q	25.1	Very low	27.8	Very low	127 Å²	127	120.7 Å²	120.7	59%	0.593	60%	0.596	S	S	*	*			cis	-159.8	147.5	-19.7	-109.2	176.3	-97.9	0	0	109.3
881	I	25.1	Very low	27.8	Very low	137 Å²	137	122.5 Å²	122.5	70%	0.703	60%	0.6	S	S	*	*				43.8	118.8	105.5	-51	179.2	0	0	0	114.3
882	S	26.6	Very low	27.9	Very low	107 Å²	107	119.6 Å²	119.6	75%	0.748	59%	0.594	S	S	*	*			cis	93.3	152.8	37.2	-52.9	0	0	0	0	114.4
883	M	26.7	Very low	27.9	Very low	150 Å²	150	121.8 Å²	121.8	74%	0.739	59%	0.594	S	S	*	*			cis	-152	-83	22.5	-147.9	-67	98.3	0	0	118
884	H	29.3	Very low	27.8	Very low	141 Å²	141	119.1 Å²	119.1	65%	0.653	59%	0.59	S	S	*	*			trans	-114.7	169.8	-172.3	-95.9	3.7	0	0	0	110.4
885	M	27.4	Very low	27.6	Very low	89 Å²	89	122.7 Å²	122.7	44%	0.438	60%	0.595	S	S	.	*			cis	-159.7	145.7	4.2	-121.8	163.6	168.2	0	0	108.1	E1095	M885-E1095 WeakPolarHBondContact CB-OE1 3.32Å
886	Q	28.3	Very low	27.5	Very low	43 Å²	43	127.1 Å²	127.1	20%	0.201	62%	0.615	C	S	.	*				85.2	140.1	110.6	-137.1	141.8	-120.5	0	0	113.6	E1095	Q886-E1095 HydrophobicContact CB-CB 4.07Å; Q886-E1095 HydrophobicContact CB-CG 3.86Å; Q886-E1095 HydrophobicContact CG-CB 4.43Å; Q886-E1095 HydrophobicContact CG-CG 3.96Å; Q886-E1095 PolarHBondContact NE2-OE1 2.94Å
887	D	26.1	Very low	27.6	Very low	40 Å²	40	120.4 Å²	120.4	21%	0.214	61%	0.612	C	S	.	*			cis	-175.4	-172.9	1.7	-118.7	-1.8	0	0	0	117.1	E1094 S1098 L1099 R1102	D887-E1094 CarbonylContact C-O 3.37Å; D887-E1094 WeakPolarHBondContact CB-O 3.39Å; D887-E1094 WeakPolarHBondContact O-CB 3.27Å; D887-S1098 VanDerWaalsContact CG-CA 3.44Å; D887-S1098 WeakPolarHBondContact OD1-CB 3.25Å; D887-S1098 PolarHBondContact OD1-OG 3.35Å; D887-S1098 WeakPolarHBondContact OD2-CA 3.34Å; D887-S1098 WeakPolarHBondContact OD2-CB 3.26Å; D887-S1098 PolarHBondContact OD2-N 2.82Å; D887-S1098 PolarHBondContact OD2-OG 3.36Å; D887-L1099 PolarHBondContact OD2-N 3.08Å; D887-R1102 IonicContact OD1-NH2 2.78Å; D887-R1102 PolarHBondContact OD1-NH2 2.85Å; D887-R1102 IonicContact OD2-CZ 3.07Å; D887-R1102 IonicContact OD2-NH2 2.77Å; D887-R1102 PolarHBondContact OD2-NH2 2.89Å
888	N	28.6	Very low	27.5	Very low	34 Å²	34	126 Å²	126	18%	0.182	62%	0.621	C	S	.	*			trans	-18	157.8	172.8	-93.3	10.8	0	0	0	122	N1097 S1098 E1101	N888-N1097 HydrophobicContact CB-CB 3.75Å; N888-N1097 PolarHBondContact ND2-O 3.34Å; N888-N1097 PolarHBondContact O-ND2 2.93Å; N888-N1097 VanDerWaalsContact O-ND2 3.13Å; N888-S1098 VanDerWaalsContact CB-N 3.3Å; N888-S1098 VanDerWaalsContact CG-CA 3.44Å; N888-S1098 WeakPolarHBondContact ND2-CA 3.31Å; N888-S1098 WeakPolarHBondContact OD1-CB 3.43Å; N888-E1101 WeakPolarHBondContact ND2-CB 3.43Å; N888-E1101 PolarHBondContact ND2-OE1 3.18Å
889	L	30.7	Very low	27.4	Very low	100 Å²	100	120.3 Å²	120.3	52%	0.524	62%	0.618	S	S	.	*				-162.2	135.7	50.7	-168.8	72.7	0	0	0	115.1	N1097	L889-N1097 HydrophobicContact CB-CB 4.43Å; L889-N1097 HydrophobicContact CD1-CB 4.41Å
890	Q	29.7	Very low	27.3	Very low	116 Å²	116	116.8 Å²	116.8	54%	0.542	62%	0.621	S	S	.	*			trans	60.5	157.6	157.9	-100.2	72.8	106.1	0	0	118.6	E1101	Q890-E1101 PolarHBondContact NE2-OE1 2.93Å
891	Q	27.9	Very low	27.5	Very low	156 Å²	156	118.6 Å²	118.6	73%	0.729	63%	0.63	S	S	*	*			cis	-158.3	175.5	-9.1	-151.1	166.8	58.9	0	0	110.5
892	Q	27.1	Very low	27.5	Very low	138 Å²	138	118.5 Å²	118.5	65%	0.645	64%	0.636	S	S	*	*			trans	74.9	121.2	154.9	-73.6	-172	-27.7	0	0	121.1
893	H	27.3	Very low	27.5	Very low	141 Å²	141	116.1 Å²	116.1	65%	0.653	63%	0.629	S	S	*	*				69.9	150	129.8	-62.3	176.8	0	0	0	119.6
894	E	26.1	Very low	27.5	Very low	140 Å²	140	116 Å²	116	65%	0.654	64%	0.636	S	S	*	*			cis	-155.5	161.8	-4.5	-118.6	167.5	122.8	0	0	112.4
895	M	25.1	Very low	27.5	Very low	149 Å²	149	113.3 Å²	113.3	73%	0.734	63%	0.633	S	S	*	*			trans	32.7	124.8	153.6	-59.8	-163.1	-165	0	0	124.1
896	M	25.9	Very low	27.6	Very low	184 Å²	184	117 Å²	117	91%	0.906	65%	0.649	S	S	*	*				67.6	129.1	120.3	-166.8	-179	-69.2	0	0	121.5
897	G	28.2	Very low	27.6	Very low	76 Å²	76	120 Å²	120	78%	0.784	68%	0.675	S	S	*	*			trans	168.7	120.3	161.9	0	0	0	0	0	116.7
898	M	28.2	Very low	28	Very low	189 Å²	189	122.9 Å²	122.9	93%	0.931	70%	0.698	S	S	*	*			trans	-65.7	162.2	-170.1	-68.1	-73.1	-172.9	0	0	119.3
899	A	25.9	Very low	28	Very low	85 Å²	85	129.3 Å²	129.3	70%	0.702	73%	0.731	S	S	*	*			trans	-33	162.7	149.6	0	0	0	0	0	116.7
900	S	28.4	Very low	28	Very low	111 Å²	111	128.4 Å²	128.4	78%	0.776	74%	0.738	S	S	*	*			cis	-168.7	-154.6	-12.1	-86.7	0	0	0	0	106.7
901	Q	28	Very low	27.9	Very low	164 Å²	164	128.1 Å²	128.1	77%	0.766	75%	0.745	S	S	*	*			cis	-166.8	156.9	8.4	-152.3	-164.9	115.3	0	0	110.6
902	T	25.9	Very low	28	Very low	135 Å²	135	126.9 Å²	126.9	83%	0.828	75%	0.748	S	S	*	*			trans	60.6	152.6	169.4	59.7	0	0	0	0	118.8
903	G	26	Very low	29.3	Very low	58 Å²	58	125.6 Å²	125.6	60%	0.598	75%	0.752	S	S	*	*			cis	163.2	160.4	-7.8	0	0	0	0	0	112.8
904	T	28.4	Very low	30.5	Very low	146 Å²	146	123.9 Å²	123.9	90%	0.896	75%	0.753	S	S	*	*			trans	67.7	157.3	176.4	78.5	0	0	0	0	115.4
905	S	27.9	Very low	30.8	Very low	85 Å²	85	122.4 Å²	122.4	59%	0.594	76%	0.758	S	S	*	*			cis	-166.8	179.8	-7.1	-116.4	0	0	0	0	108.1
906	H	30.3	Very low	31.1	Very low	168 Å²	168	121.9 Å²	121.9	78%	0.778	76%	0.764	S	S	*	*			cis	-163.9	-173.2	2.6	-120.2	-24.3	0	0	0	110.7
907	S	28.3	Very low	31.2	Very low	106 Å²	106	118.9 Å²	118.9	74%	0.741	76%	0.756	S	S	*	*			trans	84.5	146.4	150.2	-71	0	0	0	0	122.3
908	S	33.3	Very low	31	Very low	100 Å²	100	124.1 Å²	124.1	70%	0.699	76%	0.759	S	S	*	*			cis	178.5	172.5	-30.3	-109.5	0	0	0	0	112.4
909	L	30.2	Very low	31.7	Very low	168 Å²	168	120.4 Å²	120.4	88%	0.88	75%	0.749	S	S	*	*			trans	83.6	153	172.7	-54.5	-177.4	0	0	0	115.7
910	A	30.3	Very low	31.6	Very low	81 Å²	81	123.8 Å²	123.8	67%	0.669	75%	0.753	S	S	*	*			cis	-170.8	162	-15.6	0	0	0	0	0	111.1
911	T	27	Very low	31.7	Very low	110 Å²	110	128.9 Å²	128.9	68%	0.675	76%	0.755	S	S	*	*			cis	-162.2	107.4	-32.6	35.7	0	0	0	0	112.7
912	T	29.5	Very low	31.8	Very low	130 Å²	130	129.8 Å²	129.8	80%	0.798	76%	0.759	S	S	*	*			trans	75.9	-175.2	134.7	76.1	0	0	0	0	119.5
913	P	54.3	Low	32	Very low	112 Å²	112	127.9 Å²	127.9	73%	0.727	75%	0.752	S	S	*	*				-139.9	-132.5	-114.6	42.2	-15.6	0	0	0	113.1
914	P	54	Low	32.5	Very low	104 Å²	104	130 Å²	130	68%	0.675	76%	0.757	S	S	*	*			cis	-135.3	163	-33.3	37.4	-19	0	0	0	117.9
915	S	30.5	Very low	32.4	Very low	110 Å²	110	130.1 Å²	130.1	77%	0.769	76%	0.757	S	S	*	*			trans	60.2	148	140.1	-59.5	0	0	0	0	127
916	T	31.3	Very low	32.5	Very low	137 Å²	137	130 Å²	130	84%	0.84	76%	0.762	S	S	*	*			trans	85.4	145.2	151.9	-53.5	0	0	0	0	119.2
917	V	30	Very low	33.2	Very low	122 Å²	122	127.9 Å²	127.9	74%	0.739	76%	0.763	S	S	*	*			cis	-174.1	136.6	-48.2	136	0	0	0	0	111.9
918	Q	23.8	Very low	34.5	Very low	185 Å²	185	128.3 Å²	128.3	86%	0.864	76%	0.763	S	S	*	*			trans	57.5	170.5	169.1	-82.5	-164.9	27.2	0	0	119.2
919	P	41.3	Very low	35.3	Very low	111 Å²	111	128.7 Å²	128.7	72%	0.721	76%	0.763	S	S	*	*			cis	-132.7	169.5	-18.7	31.7	-10.2	0	0	0	117.5
920	M	24.5	Very low	35.3	Very low	157 Å²	157	125.6 Å²	125.6	77%	0.773	76%	0.755	S	S	*	*			trans	18.6	124.1	145.3	-159.4	164.9	179.4	0	0	126.1
921	R	31.6	Very low	35.3	Very low	218 Å²	218	128.8 Å²	128.8	82%	0.823	76%	0.757	S	S	*	*			trans	59.1	134.1	143.3	-79.5	-170.4	175	-179.1	-2.5	125.3
922	Q	29.2	Very low	35.4	Very low	182 Å²	182	133.2 Å²	133.2	85%	0.85	76%	0.761	S	S	*	*				-167.9	177.9	118.7	-107.8	179.2	99.6	0	0	108.7
923	S	30.7	Very low	35.2	Very low	96 Å²	96	132.7 Å²	132.7	67%	0.671	76%	0.757	S	S	*	*			cis	-170.1	174	-10.3	42.9	0	0	0	0	106.6
924	S	36.3	Very low	33.9	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	76%	0.761	S	S	*	*			cis	-169.6	-173.9	-27.9	-83.4	0	0	0	0	108.5
925	V	26.9	Very low	32.5	Very low	148 Å²	148	135.9 Å²	135.9	90%	0.897	76%	0.762	S	S	*	*			trans	77.4	128.5	169.4	-176.2	0	0	0	0	116.4
926	A	29.1	Very low	32.3	Very low	83 Å²	83	138.4 Å²	138.4	69%	0.686	76%	0.761	S	S	*	*			cis	-157	-160.8	-16.5	0	0	0	0	0	110.4
927	P	45.9	Very low	32	Very low	123 Å²	123	137.4 Å²	137.4	80%	0.799	76%	0.755	S	S	*	*				-128.2	-141.1	-116.5	40.1	-15.2	0	0	0	116.9
928	P	55.7	Low	31.8	Very low	115 Å²	115	136.1 Å²	136.1	75%	0.747	75%	0.751	S	S	*	*				-120.4	-152	-122.3	41.2	-18.1	0	0	0	112.8
929	P	48.7	Very low	32	Very low	108 Å²	108	135.5 Å²	135.5	70%	0.701	75%	0.748	S	S	*	*			cis	-140.2	-159	-3.2	43.9	-22.7	0	0	0	116.2
930	S	31.7	Very low	31.2	Very low	102 Å²	102	138 Å²	138	71%	0.713	75%	0.75	S	S	*	*			trans	74.5	160.1	161.3	-65	0	0	0	0	118.7
931	Q	28.8	Very low	31.2	Very low	149 Å²	149	137.2 Å²	137.2	70%	0.696	75%	0.749	S	S	*	*			cis	-153.1	146.1	-30.4	-105.3	-153.9	109.4	0	0	108
932	R	28.7	Very low	30.8	Very low	202 Å²	202	131.5 Å²	131.5	76%	0.762	74%	0.742	S	S	*	*				65.8	129.7	87.1	-132.9	-174.9	-179.2	169.1	2.1	114.3
933	V	26.8	Very low	30.7	Very low	119 Å²	119	129 Å²	129	72%	0.721	74%	0.739	S	S	*	*			cis	-137.1	136.2	21.4	-154	0	0	0	0	108.3
934	K	26.1	Very low	30.5	Very low	184 Å²	184	129.9 Å²	129.9	80%	0.8	75%	0.745	S	S	*	*				58.2	144.7	67.2	-81.2	-170	178.7	-170	0	114.2
935	S	25.3	Very low	30	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	75%	0.75	S	S	*	*			cis	-162.4	146.2	25.1	50.9	0	0	0	0	117.5
936	Q	25.3	Very low	30	Very low	163 Å²	163	127.4 Å²	127.4	76%	0.762	75%	0.746	S	S	*	*			trans	47	116.7	134.2	-78.5	175.5	-81.3	0	0	125.9
937	T	26.3	Very low	29.8	Very low	115 Å²	115	128.6 Å²	128.6	71%	0.706	76%	0.756	S	S	*	*				42	127.8	118.2	62.9	0	0	0	0	124.6
938	S	25.5	Very low	28.9	Very low	95 Å²	95	127.1 Å²	127.1	66%	0.664	75%	0.754	S	S	*	*				101.3	129.7	126.9	-74	0	0	0	0	124
939	H	27.8	Very low	28.3	Very low	172 Å²	172	127.2 Å²	127.2	80%	0.796	76%	0.755	S	S	*	*			trans	75.5	125.8	147.7	-63	-49.7	0	0	0	123.8
940	Q	23.9	Very low	27.3	Very low	163 Å²	163	126.7 Å²	126.7	76%	0.762	76%	0.76	S	S	*	*				97.9	142.4	128.3	-96.9	-169.3	40.5	0	0	123.7
941	L	25.1	Very low	27.2	Very low	142 Å²	142	126 Å²	126	74%	0.743	76%	0.76	S	S	*	*			trans	80.4	98.9	152.7	-64.5	161.8	0	0	0	122.4
942	S	24	Very low	27.1	Very low	97 Å²	97	125.1 Å²	125.1	68%	0.678	77%	0.77	S	S	*	*				103.6	145.7	108.2	-68.4	0	0	0	0	124.4
943	V	26.5	Very low	27.1	Very low	131 Å²	131	118.9 Å²	118.9	79%	0.794	77%	0.769	S	S	*	*			trans	64	93.3	153.8	-66.8	0	0	0	0	123.5
944	S	25.2	Very low	27.1	Very low	113 Å²	113	122.4 Å²	122.4	79%	0.79	77%	0.774	S	S	*	*				40.7	147.1	105.9	-51	0	0	0	0	124.6
945	A	27.7	Very low	27.2	Very low	100 Å²	100	118 Å²	118	83%	0.826	77%	0.766	S	S	*	*			trans	80.7	148.5	154.9	0	0	0	0	0	118.9
946	A	25.8	Very low	27.2	Very low	100 Å²	100	121 Å²	121	83%	0.826	76%	0.763	S	S	*	*			cis	-170.3	-175.3	-17.8	0	0	0	0	0	111.7
947	A	25	Very low	27.6	Very low	108 Å²	108	119.1 Å²	119.1	89%	0.893	76%	0.764	S	S	*	*			trans	103.3	158.1	158.9	0	0	0	0	0	120.9
948	A	27.6	Very low	27.7	Very low	92 Å²	92	121.1 Å²	121.1	76%	0.76	77%	0.766	S	S	*	*			trans	-141.6	-155.5	-175.8	0	0	0	0	0	108.2
949	P	43.5	Very low	27.9	Very low	117 Å²	117	122.7 Å²	122.7	76%	0.76	78%	0.776	S	S	*	*			cis	-144.4	-168.7	-3	44.5	-23.8	0	0	0	117.5
950	A	26.7	Very low	27.8	Very low	97 Å²	97	117.9 Å²	117.9	80%	0.802	77%	0.773	S	S	*	*			trans	72.2	159.6	149.6	0	0	0	0	0	122
951	A	30.3	Very low	27.8	Very low	86 Å²	86	117.6 Å²	117.6	71%	0.711	78%	0.777	S	S	*	*			cis	-173	165.9	-28.5	0	0	0	0	0	114.3
952	S	27.1	Very low	27.8	Very low	132 Å²	132	117.1 Å²	117.1	92%	0.923	78%	0.775	S	S	*	*			trans	75	158.4	164.3	80.1	0	0	0	0	120.7
953	G	28.1	Very low	27.7	Very low	70 Å²	70	118.8 Å²	118.8	72%	0.722	78%	0.775	S	S	*	*			cis	170.1	142.4	-16.4	0	0	0	0	0	118.8
954	K	27.1	Very low	27.5	Very low	193 Å²	193	120.3 Å²	120.3	84%	0.839	77%	0.774	S	S	*	*			trans	72.9	124.3	151.2	-68.7	-178.5	-179.6	174.9	0	126.2
955	S	26.6	Very low	27.5	Very low	91 Å²	91	119.8 Å²	119.8	64%	0.636	77%	0.77	S	S	*	*				97.9	-179.7	128.6	81.6	0	0	0	0	124
956	R	26.5	Very low	27.9	Very low	165 Å²	165	120 Å²	120	62%	0.623	76%	0.763	S	S	*	*			trans	-160	148	-159.5	173.6	-118.9	-174.2	142.6	-4.9	111.3
957	P	33.8	Very low	27.8	Very low	122 Å²	122	123.6 Å²	123.6	79%	0.792	76%	0.763	S	S	*	*				-145.1	-163.8	128.8	39	-22.9	0	0	0	114.9
958	Q	29.1	Very low	27.8	Very low	158 Å²	158	124.5 Å²	124.5	74%	0.738	76%	0.763	S	S	*	*			trans	-139.3	144.6	175.7	-83.1	174.7	-97.1	0	0	111.4
959	S	28	Very low	27.8	Very low	127 Å²	127	122.9 Å²	122.9	89%	0.888	76%	0.755	S	S	*	*			trans	-177.4	165	154.1	45.1	0	0	0	0	108.4
960	G	25.4	Very low	27	Very low	71 Å²	71	129.2 Å²	129.2	73%	0.732	77%	0.765	S	S	*	*			cis	150.1	120.4	-14.3	0	0	0	0	0	114.2
961	N	25.6	Very low	27.1	Very low	158 Å²	158	128.1 Å²	128.1	85%	0.845	76%	0.763	S	S	*	*			trans	85.5	150.2	152	-114.5	13.7	0	0	0	122.3
962	L	24.3	Very low	26.9	Very low	132 Å²	132	127.2 Å²	127.2	69%	0.691	76%	0.763	S	S	*	*			trans	93.5	118.6	148	-71.9	162.4	0	0	0	123.2
963	L	23	Very low	26.9	Very low	132 Å²	132	131.6 Å²	131.6	69%	0.691	76%	0.759	S	S	*	*			trans	70.5	150.9	144.4	-53.6	172	0	0	0	118.4
964	Q	21.9	Very low	26.7	Very low	163 Å²	163	135 Å²	135	76%	0.762	76%	0.756	S	S	*	*			cis	-152	169	-9.1	-134.6	158.1	-15	0	0	113.1
965	S	24.2	Very low	26.6	Very low	101 Å²	101	134.6 Å²	134.6	71%	0.706	76%	0.757	S	S	*	*			trans	-34.8	163.8	158.7	-64.5	0	0	0	0	116.6
966	P	35.8	Very low	26.5	Very low	106 Å²	106	134.2 Å²	134.2	69%	0.688	77%	0.768	S	S	*	*			cis	-146.7	156.9	36.7	41.5	-20.6	0	0	0	121.9
967	E	23.6	Very low	26.3	Very low	175 Å²	175	131.3 Å²	131.3	82%	0.818	77%	0.772	S	S	*	*			trans	33.6	122.1	132.3	-53.8	172.6	106.4	0	0	121.8
968	S	26.6	Very low	25.8	Very low	127 Å²	127	136.1 Å²	136.1	89%	0.888	78%	0.775	S	S	*	*				170.8	147.5	104.6	-74.6	0	0	0	0	111.2
969	G	26.2	Very low	25.5	Very low	58 Å²	58	135.6 Å²	135.6	60%	0.598	77%	0.772	S	S	*	*			cis	158.2	125.9	-8.2	0	0	0	0	0	112.1
970	Y	28.3	Very low	25.4	Very low	249 Å²	249	136.8 Å²	136.8	98%	0.976	77%	0.768	S	S	*	*			trans	63.8	152.8	174.3	-60.6	-89.1	0	0	0	116.9
971	G	27.3	Very low	25.3	Very low	74 Å²	74	138.6 Å²	138.6	76%	0.763	77%	0.769	S	S	*	*			cis	163.3	154.9	-7.8	0	0	0	0	0	110.5
972	G	27	Very low	25.4	Very low	68 Å²	68	138.1 Å²	138.1	70%	0.701	77%	0.772	S	S	*	*			cis	164.6	-168.2	-2.8	0	0	0	0	0	110.6
973	R	26.1	Very low	25.4	Very low	223 Å²	223	139.8 Å²	139.8	84%	0.842	77%	0.774	S	S	*	*			trans	70.7	151.6	169.7	-61.4	-178.3	170.2	-138.7	9	116.5
974	Q	25.4	Very low	25.4	Very low	142 Å²	142	138.8 Å²	138.8	66%	0.664	77%	0.769	S	S	*	*			cis	-151.5	165.5	-12.6	-124.7	166.2	-34.2	0	0	114.1
975	H	24.6	Very low	25.5	Very low	185 Å²	185	139 Å²	139	86%	0.856	78%	0.775	S	S	*	*			trans	-30.5	155.9	160.5	-76.3	-120.6	0	0	0	118
976	G	23.3	Very low	25.7	Very low	83 Å²	83	140.4 Å²	140.4	86%	0.856	78%	0.779	S	S	*	*			trans	-171.6	66.1	167.7	0	0	0	0	0	115.5
977	S	22.8	Very low	25.6	Very low	103 Å²	103	139.6 Å²	139.6	72%	0.72	78%	0.782	S	S	*	*			trans	-71.6	162.5	179	56.1	0	0	0	0	115.3
978	R	23.1	Very low	25.9	Very low	224 Å²	224	137.9 Å²	137.9	85%	0.845	79%	0.786	S	S	*	*			trans	102.6	158.1	162.3	-65.5	-174.9	176.8	-176.8	-1.5	116.4
979	Q	23	Very low	25.7	Very low	147 Å²	147	135.1 Å²	135.1	69%	0.687	78%	0.777	S	S	*	*			cis	-175.9	165.5	-30.8	-168.5	168.2	-6.4	0	0	108.1
980	L	25.1	Very low	26	Very low	151 Å²	151	140.5 Å²	140.5	79%	0.791	79%	0.791	S	S	*	*			trans	74.2	133.4	173.8	-46.8	172.3	0	0	0	113.9
981	S	24.8	Very low	26.5	Very low	110 Å²	110	134.5 Å²	134.5	77%	0.769	78%	0.783	S	S	*	*			cis	81	102.2	17.2	-162.3	0	0	0	0	117
982	V	26.1	Very low	26.5	Very low	148 Å²	148	138.1 Å²	138.1	90%	0.897	78%	0.78	S	S	*	*			trans	-144.4	166.7	144.5	166.8	0	0	0	0	108.3
983	K	24.2	Very low	26.5	Very low	167 Å²	167	142 Å²	142	73%	0.726	78%	0.78	S	S	*	*			trans	-95.7	166	-157	-91	163.5	137.5	-89.2	0	116.7
984	D	24.6	Very low	26.5	Very low	110 Å²	110	138.5 Å²	138.5	59%	0.588	77%	0.773	S	S	*	*			trans	43.3	126.7	139.7	-50	-26.1	0	0	0	121.3
985	N	23.5	Very low	26.6	Very low	168 Å²	168	136.8 Å²	136.8	90%	0.898	78%	0.777	S	S	*	*				-175.9	163.4	112.9	-98.7	-45.4	0	0	0	114.1
986	T	28.8	Very low	26.9	Very low	130 Å²	130	133.4 Å²	133.4	80%	0.798	77%	0.774	S	S	*	*			trans	-123.8	130.1	-179	-61.1	0	0	0	0	111
987	A	33.3	Very low	27.3	Very low	90 Å²	90	135.2 Å²	135.2	74%	0.744	77%	0.768	S	S	*	*			trans	56.8	145.6	164.6	0	0	0	0	0	119.1
988	P	29.5	Very low	27.8	Very low	139 Å²	139	140.1 Å²	140.1	90%	0.903	77%	0.771	S	S	*	*				-143.7	-170.9	105.2	39.5	-25.4	0	0	0	113.5
989	G	22.4	Very low	28	Very low	68 Å²	68	136.1 Å²	136.1	70%	0.701	76%	0.762	S	S	*	*			trans	-169.9	-171.4	174.8	0	0	0	0	0	114.3
990	L	32.1	Very low	28.2	Very low	171 Å²	171	134.4 Å²	134.4	90%	0.895	77%	0.766	S	S	*	*			trans	69.9	158.4	-178.5	-66.7	171.6	0	0	0	114.9
991	P	39.5	Very low	28.1	Very low	124 Å²	124	130.1 Å²	130.1	81%	0.805	76%	0.758	S	S	*	*			cis	-127.8	-158.8	29.7	27.5	-2.1	0	0	0	115
992	H	28.1	Very low	28.2	Very low	149 Å²	149	130.6 Å²	130.6	69%	0.69	76%	0.761	S	S	*	*				-176	173	-54.6	-170.2	40.5	0	0	0	110.6
993	Q	26.6	Very low	29.5	Very low	150 Å²	150	128.6 Å²	128.6	70%	0.701	75%	0.751	S	S	*	*			trans	68.1	156.8	167.1	-72.4	-165.4	10.8	0	0	121.4
994	Q	25.2	Very low	29.8	Very low	149 Å²	149	130 Å²	130	70%	0.696	76%	0.76	S	S	*	*			cis	-172	-179.7	-37.6	-122.9	175.5	1.6	0	0	113.8
995	S	27.5	Very low	29.9	Very low	107 Å²	107	127.4 Å²	127.4	75%	0.748	76%	0.76	S	S	*	*			trans	74.8	134.9	169.9	72.5	0	0	0	0	118.8
996	S	31.3	Very low	30.3	Very low	114 Å²	114	126 Å²	126	80%	0.797	76%	0.758	S	S	*	*			cis	83.5	148.3	-4.9	100.5	0	0	0	0	118.5
997	V	31.9	Very low	30.3	Very low	121 Å²	121	125.7 Å²	125.7	73%	0.733	76%	0.756	S	S	*	*			cis	-167.3	172	8	74.7	0	0	0	0	114
998	R	33.7	Very low	30	Very low	206 Å²	206	126 Å²	126	78%	0.777	75%	0.752	S	S	*	*			trans	81.6	162.1	156.9	-83	171.6	173.4	-121.3	-6.6	121.5
999	E	26.4	Very low	30	Very low	140 Å²	140	128 Å²	128	65%	0.654	75%	0.75	S	S	*	*			cis	-118.6	-168.9	2.2	-101.3	-61.6	109.4	0	0	110.5
1000	S	28.5	Very low	30.1	Very low	111 Å²	111	129.8 Å²	129.8	78%	0.776	75%	0.751	S	S	*	*			cis	-143	-151	4.6	61.9	0	0	0	0	110.1
1001	G	22.5	Very low	29.7	Very low	60 Å²	60	127.5 Å²	127.5	62%	0.619	75%	0.745	S	S	*	*			cis	-179.6	-172.2	8.9	0	0	0	0	0	113.4
1002	S	25.8	Very low	28.9	Very low	120 Å²	120	129.3 Å²	129.3	84%	0.839	74%	0.743	S	S	*	*			trans	-155	-176.6	-162.7	-33.9	0	0	0	0	113.8
1003	P	53.7	Low	28.9	Very low	106 Å²	106	131 Å²	131	69%	0.688	75%	0.751	S	S	*	*			cis	-138.5	-179.4	-11.4	42.5	-24.8	0	0	0	117.2
1004	Q	30.2	Very low	28.7	Very low	196 Å²	196	129 Å²	129	92%	0.916	75%	0.753	S	S	*	*			trans	67.4	139.5	156.3	-77	171.7	-49	0	0	121.4
1005	G	28	Very low	29.5	Very low	57 Å²	57	126.6 Å²	126.6	59%	0.588	75%	0.751	S	S	*	*			cis	170.7	169.7	-10.6	0	0	0	0	0	116.4
1006	T	30.5	Very low	29.3	Very low	139 Å²	139	128.5 Å²	128.5	85%	0.853	75%	0.748	S	S	*	*			trans	67.2	150.9	164.8	64.8	0	0	0	0	118.1
1007	T	29.6	Very low	29	Very low	122 Å²	122	129.5 Å²	129.5	75%	0.748	74%	0.74	S	S	*	*			cis	-172.3	160.2	-11.4	24	0	0	0	0	108
1008	S	28	Very low	28.7	Very low	96 Å²	96	129.7 Å²	129.7	67%	0.671	75%	0.746	S	S	*	*			cis	-179.2	153.7	-27.3	53	0	0	0	0	112.1
1009	Q	27.7	Very low	28.2	Very low	182 Å²	182	126 Å²	126	85%	0.85	74%	0.738	S	S	*	*			trans	71.5	122.3	154.9	-76.5	-170.2	1.7	0	0	123.8
1010	S	24.5	Very low	28.2	Very low	105 Å²	105	125.5 Å²	125.5	73%	0.734	74%	0.736	S	S	*	*				102.9	147.3	125	82.4	0	0	0	0	123.1
1011	T	24.6	Very low	28	Very low	124 Å²	124	127.3 Å²	127.3	76%	0.761	73%	0.732	S	S	*	*			trans	89.7	152.5	148.9	-42.9	0	0	0	0	119.2
1012	Q	23.7	Very low	28.1	Very low	162 Å²	162	130.7 Å²	130.7	76%	0.757	74%	0.735	S	S	*	*			trans	-67.3	149.2	-173	-52.5	144.9	-16.5	0	0	112.6
1013	Q	26.6	Very low	28.1	Very low	183 Å²	183	131.1 Å²	131.1	86%	0.855	73%	0.727	S	S	*	*				179.6	147.9	101.9	-95.3	177.4	19.6	0	0	113.2
1014	S	22	Very low	26.7	Very low	108 Å²	108	134.8 Å²	134.8	76%	0.755	73%	0.732	S	S	*	*			trans	-109.5	179.2	162.4	1	0	0	0	0	107.8
1015	P	43.4	Very low	27	Very low	99 Å²	99	130.2 Å²	130.2	64%	0.643	72%	0.719	S	S	*	*			cis	-135.3	-149.1	-23	31.2	-7.4	0	0	0	110.1
1016	Q	23.1	Very low	26.7	Very low	147 Å²	147	132.9 Å²	132.9	69%	0.687	73%	0.725	S	S	*	*			trans	70.4	164.4	150.8	-76.8	170.5	-33.7	0	0	116.7
1017	Q	25.1	Very low	26.4	Very low	136 Å²	136	134.4 Å²	134.4	64%	0.636	72%	0.724	S	S	*	*			cis	-148.3	149.6	-1.1	-138.8	156.7	2.8	0	0	111.9
1018	S	25.6	Very low	26.3	Very low	124 Å²	124	133.7 Å²	133.7	87%	0.867	72%	0.724	S	S	*	*			trans	-145.7	50.9	160.7	52.7	0	0	0	0	111.8
1019	Q	23.7	Very low	26.2	Very low	129 Å²	129	138.7 Å²	138.7	60%	0.603	73%	0.734	S	S	*	*			trans	-87.9	116.6	160.9	-82.4	-173.2	-73.8	0	0	107.8
1020	Q	26.1	Very low	26.1	Very low	130 Å²	130	138.9 Å²	138.9	61%	0.607	74%	0.735	S	S	*	*				85.8	149	81.6	-80.5	-179.4	-36.2	0	0	112.9
1021	H	24.5	Very low	26.2	Very low	148 Å²	148	137 Å²	137	69%	0.685	73%	0.732	S	S	*	*			trans	71.8	152.5	162.9	-62.3	-50.6	0	0	0	116.3
1022	L	24.3	Very low	26.3	Very low	131 Å²	131	136.3 Å²	136.3	69%	0.686	73%	0.732	S	S	*	*			cis	-154.9	154.9	-1.3	-138.5	5.9	0	0	0	112.1
1023	L	25	Very low	26.4	Very low	129 Å²	129	138.1 Å²	138.1	68%	0.675	74%	0.741	S	S	*	*			trans	69.7	111.1	145.3	-74.8	163.8	0	0	0	123.9
1024	K	24.5	Very low	26.4	Very low	183 Å²	183	134.6 Å²	134.6	80%	0.796	74%	0.737	S	S	*	*				70.5	174.5	115	-95.9	-165.1	-168.6	176.3	0	118.2
1025	P	36.7	Very low	27.4	Very low	100 Å²	100	134.5 Å²	134.5	65%	0.649	73%	0.733	S	S	*	*				-139.8	177.2	-88	37.5	-14.8	0	0	0	117.5
1026	T	22.3	Very low	26.6	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	74%	0.735	S	S	*	*			trans	80.2	150.4	150.1	7	0	0	0	0	121.5
1027	M	23.3	Very low	26.9	Very low	171 Å²	171	134 Å²	134	84%	0.842	74%	0.738	S	S	*	*			trans	79.9	152.3	162.4	-66.9	-65	102.3	0	0	119
1028	S	27.4	Very low	27	Very low	107 Å²	107	135.6 Å²	135.6	75%	0.748	75%	0.751	S	S	*	*			trans	-128.1	151.9	-162.9	51.1	0	0	0	0	112
1029	K	26.9	Very low	27.2	Very low	201 Å²	201	137.3 Å²	137.3	87%	0.874	75%	0.75	S	S	*	*			trans	-163.8	174.2	153.9	-119	171.2	-176.6	-178.8	0	113.5
1030	Q	25.3	Very low	28.2	Very low	185 Å²	185	136 Å²	136	86%	0.864	75%	0.753	S	S	*	*			trans	-91.2	164.3	-167.1	-56.1	139.5	-75.1	0	0	113.6
1031	G	25.7	Very low	28.8	Very low	66 Å²	66	135.8 Å²	135.8	68%	0.68	76%	0.763	S	S	*	*			trans	145.1	106.4	159.6	0	0	0	0	0	111.4
1032	S	26.3	Very low	29.3	Very low	110 Å²	110	135 Å²	135	77%	0.769	77%	0.768	S	S	*	*			cis	86.8	110.3	46.6	77.2	0	0	0	0	114.5
1033	Q	27.1	Very low	30.4	Very low	199 Å²	199	134.3 Å²	134.3	93%	0.93	77%	0.772	S	S	*	*			trans	-173.3	161.3	131.9	-102.1	164.9	25.5	0	0	111.9
1034	S	25.9	Very low	30.6	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	77%	0.774	S	S	*	*			trans	-128.7	-164	-177.6	57.2	0	0	0	0	107.7
1035	P	42.5	Very low	31	Very low	106 Å²	106	131 Å²	131	69%	0.688	78%	0.776	S	S	*	*			cis	-146.7	-152.6	9.2	40.7	-15.9	0	0	0	116.2
1036	T	27.1	Very low	30.5	Very low	112 Å²	112	133.5 Å²	133.5	69%	0.687	78%	0.779	S	S	*	*			trans	87.8	86.8	148.9	36	0	0	0	0	123.5
1037	T	29.9	Very low	31	Very low	122 Å²	122	138.2 Å²	138.2	75%	0.748	78%	0.784	S	S	*	*				51.1	145.9	111.9	61.9	0	0	0	0	125.1
1038	L	27.3	Very low	31.5	Very low	171 Å²	171	136.8 Å²	136.8	90%	0.895	79%	0.785	S	S	*	*			trans	114.1	155.1	149.3	-66	-176.2	0	0	0	118.3
1039	N	29.2	Very low	31.4	Very low	160 Å²	160	138.1 Å²	138.1	86%	0.856	79%	0.788	S	S	*	*			trans	-118.5	173.5	-164.4	-122.4	0.1	0	0	0	111.5
1040	P	44.7	Very low	31.7	Very low	101 Å²	101	132.6 Å²	132.6	66%	0.656	78%	0.78	S	S	*	*			trans	-92.4	169	-157.3	37.1	-39.7	0	0	0	116.6
1041	P	39.8	Very low	32.1	Very low	126 Å²	126	135.4 Å²	135.4	82%	0.818	78%	0.783	S	S	*	*			trans	-85.8	166.8	168.3	35.9	-35.2	0	0	0	114.3
1042	T	34.3	Very low	32.5	Very low	131 Å²	131	137.1 Å²	137.1	80%	0.804	78%	0.78	S	S	*	*			trans	-110.9	-157.4	-178.4	53.6	0	0	0	0	109.2
1043	P	47.2	Very low	32.7	Very low	116 Å²	116	136 Å²	136	75%	0.753	77%	0.771	S	S	*	*			cis	-145.3	-169.1	0.8	42.7	-20.9	0	0	0	118.2
1044	A	30.4	Very low	33	Very low	88 Å²	88	132.7 Å²	132.7	73%	0.727	76%	0.761	S	S	*	*			trans	96.5	94.2	141.1	0	0	0	0	0	122.5
1045	N	31.1	Very low	33.4	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	76%	0.76	S	S	*	*				21.1	141.8	117.6	-80.4	0.4	0	0	0	121.6
1046	E	27.9	Very low	33.8	Very low	153 Å²	153	133.8 Å²	133.8	72%	0.715	75%	0.753	S	S	*	*				-165.4	179.8	95.6	-98	-122.5	108	0	0	113.9
1047	R	31	Very low	33.9	Very low	212 Å²	212	136.2 Å²	136.2	80%	0.8	76%	0.757	S	S	*	*			trans	-92.1	168.3	-162.8	-53.7	149.1	167.8	133.5	-16.4	113.5
1048	T	33.8	Very low	33.9	Very low	142 Å²	142	137.5 Å²	137.5	87%	0.871	76%	0.758	S	S	*	*				-170.2	158.8	129	-80.8	0	0	0	0	111.3
1049	V	27.1	Very low	34.1	Very low	135 Å²	135	134.8 Å²	134.8	82%	0.818	75%	0.753	S	S	*	*			trans	-101.7	162.3	-172.9	175.7	0	0	0	0	111.7
1050	A	32	Very low	34.4	Very low	84 Å²	84	131.5 Å²	131.5	69%	0.694	75%	0.748	S	S	*	*			trans	-66.3	170.2	178.2	0	0	0	0	0	115.2
1051	W	33.9	Very low	34.4	Very low	245 Å²	245	134.1 Å²	134.1	93%	0.928	76%	0.757	S	S	*	*			trans	-177.3	157	155.3	-103.5	31.8	0	0	0	106.6
1052	V	33.2	Very low	34.7	Very low	102 Å²	102	135.6 Å²	135.6	62%	0.618	76%	0.756	S	S	*	*			cis	-150.2	144.3	6.4	132.3	0	0	0	0	105
1053	S	32.2	Very low	35.1	Very low	85 Å²	85	134.9 Å²	134.9	59%	0.594	74%	0.744	S	S	*	*			cis	96.6	159.9	23.5	87.7	0	0	0	0	116.2
1054	N	33.1	Very low	34.9	Very low	131 Å²	131	134.5 Å²	134.5	70%	0.701	74%	0.744	S	S	*	*			trans	72.6	141.5	178.5	-66.5	7	0	0	0	117.1
1055	M	34.2	Very low	35.6	Very low	156 Å²	156	135.8 Å²	135.8	77%	0.768	75%	0.747	S	S	*	*			cis	-151.4	-176.9	-6.4	-111.1	-52.1	145.1	0	0	109.5
1056	P	50.4	Low	36.4	Very low	83 Å²	83	136.8 Å²	136.8	54%	0.539	74%	0.74	S	S	.	*			trans	-120.5	-166.6	-143.2	41.7	-22.4	0	0	0	114
1057	H	30.2	Very low	37.6	Very low	163 Å²	163	134.5 Å²	134.5	76%	0.755	73%	0.731	S	S	*	*				173.1	142	115.8	-93.7	-67.4	0	0	0	115.3
1058	L	29.7	Very low	38.5	Very low	149 Å²	149	130.5 Å²	130.5	78%	0.78	73%	0.726	S	S	*	*			trans	73.5	149.9	152.8	-94.8	65.2	0	0	0	121.9
1059	S	31.7	Very low	39.4	Very low	114 Å²	114	133.4 Å²	133.4	80%	0.797	72%	0.721	S	S	*	*			trans	65.1	90.1	169.1	-54	0	0	0	0	116.1
1060	A	35.3	Very low	40.6	Very low	91 Å²	91	133.5 Å²	133.5	75%	0.752	71%	0.712	S	S	*	*			cis	90.1	111.4	47.1	0	0	0	0	0	114.8
1061	D	43.8	Very low	41.5	Very low	155 Å²	155	134.3 Å²	134.3	83%	0.829	71%	0.705	S	S	*	*			trans	69.1	153.9	157.4	-56.3	-35.6	0	0	0	122.4
1062	I	45.7	Very low	42.5	Very low	157 Å²	157	130.4 Å²	130.4	81%	0.805	70%	0.695	S	S	*	*	S	Bend	trans	76.9	65.4	174.8	-37.4	174.5	0	0	0	117.2
1063	E	43.9	Very low	43.5	Very low	116 Å²	116	132.2 Å²	132.2	54%	0.542	70%	0.695	S	S	.	*			trans	-162.5	-4.4	149.3	-150	63.4	-93	0	0	115.1	S1065 R1066	E1063-S1065 PolarHBondContact O-N 3Å; E1063-R1066 PolarHBondContact O-N 3.04Å; E1063-R1066 VanDerWaalsContact OE1-CD 3.28Å; E1063-R1066 WeakPolarHBondContact OE1-CD 3.4Å; E1063-R1066 IonicContact OE1-NE 3.05Å; E1063-R1066 PolarHBondContact OE1-NE 3.05Å
1064	S	43	Very low	44.6	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	13.6	-162.8	52.1	0	0	0	0	118
1065	S	44.2	Very low	45.7	Very low	115 Å²	115	135.1 Å²	135.1	80%	0.804	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.1	10	175.3	-59.3	0	0	0	0	114.6	E1063	E1063-S1065 PolarHBondContact O-N 3Å
1066	R	49	Very low	46.7	Very low	176 Å²	176	134.3 Å²	134.3	66%	0.664	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-38.1	172.8	-69	-170.8	-175.3	-101.8	-2.6	114.1	E1063 R1069	E1063-R1066 PolarHBondContact O-N 3.04Å; E1063-R1066 VanDerWaalsContact OE1-CD 3.28Å; E1063-R1066 WeakPolarHBondContact OE1-CD 3.4Å; E1063-R1066 IonicContact OE1-NE 3.05Å; E1063-R1066 PolarHBondContact OE1-NE 3.05Å; R1066-R1069 PolarHBondContact O-N 3.36Å
1067	I	51.8	Low	46.8	Very low	105 Å²	105	138.9 Å²	138.9	54%	0.538	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	-47.3	-163.5	-60.5	174.2	0	0	0	112.6	R1069 E1070 D1071	I1067-R1069 PolarHBondContact O-N 3.35Å; I1067-E1070 PolarHBondContact O-N 3.48Å; I1067-D1071 PolarHBondContact O-N 2.8Å
1068	D	51.4	Low	48.2	Very low	129 Å²	129	134.4 Å²	134.4	69%	0.69	68%	0.684	S	S	*	*	H	α-helix	trans	-55	-29.6	-177.6	-73	-32.6	0	0	0	114	F1072	D1068-F1072 PolarHBondContact O-N 3.06Å
1069	R	52.6	Low	49.5	Very low	203 Å²	203	133.8 Å²	133.8	77%	0.766	68%	0.675	S	S	*	*	H	α-helix	trans	-88.8	-8.5	-177.2	-160.2	157.2	76.4	157.8	1.3	114.1	R1066 I1067	R1066-R1069 PolarHBondContact O-N 3.36Å; I1067-R1069 PolarHBondContact O-N 3.35Å
1070	E	50.9	Low	51	Low	136 Å²	136	131.7 Å²	131.7	64%	0.636	66%	0.66	S	S	*	*	H	α-helix	trans	-96.7	-39.8	172.5	-60.3	-163.3	160.6	0	0	110.9	I1067 F1072 K1073 L1074	I1067-E1070 PolarHBondContact O-N 3.48Å; E1070-F1072 PolarHBondContact O-N 3.46Å; E1070-K1073 PolarHBondContact O-N 2.91Å; E1070-L1074 PolarHBondContact O-N 2.97Å
1071	D	52.2	Low	52.1	Low	102 Å²	102	132.6 Å²	132.6	55%	0.545	65%	0.65	S	S	.	*	H	α-helix	trans	-61	-40.5	172.8	-101.8	-1	0	0	0	112.7	I1067 K1073 L1074 K1075	I1067-D1071 PolarHBondContact O-N 2.8Å; D1071-K1073 VanDerWaalsContact C-N 3.31Å; D1071-K1073 PolarHBondContact O-N 3.28Å; D1071-L1074 PolarHBondContact O-N 2.87Å; D1071-K1075 PolarHBondContact O-N 3.36Å
1072	F	53.8	Low	53.1	Low	162 Å²	162	129.5 Å²	129.5	71%	0.711	63%	0.634	S	S	*	*	H	α-helix	trans	-61.6	-40.2	176	-129.3	-85.6	0	0	0	112	D1068 E1070 K1075 E1076	D1068-F1072 PolarHBondContact O-N 3.06Å; E1070-F1072 PolarHBondContact O-N 3.46Å; F1072-K1075 PolarHBondContact O-N 3.23Å; F1072-E1076 WeakPolarHBondContact O-CB 3.34Å; F1072-E1076 PolarHBondContact O-N 2.76Å
1073	K	54.5	Low	54	Low	141 Å²	141	127.2 Å²	127.2	61%	0.613	62%	0.62	S	S	*	*	H	α-helix	trans	-68.3	-41.7	176.1	-80.2	-175.6	170.8	-174.2	0	112.3	E1070 D1071 K1075 E1076 Y1077	E1070-K1073 PolarHBondContact O-N 2.91Å; D1071-K1073 VanDerWaalsContact C-N 3.31Å; D1071-K1073 PolarHBondContact O-N 3.28Å; K1073-K1075 VanDerWaalsContact C-N 3.3Å; K1073-K1075 PolarHBondContact O-N 2.87Å; K1073-E1076 PolarHBondContact O-N 2.59Å; K1073-Y1077 VanDerWaalsContact O-CB 3.28Å; K1073-Y1077 WeakPolarHBondContact O-CB 3.41Å; K1073-Y1077 PolarHBondContact O-N 3.22Å
1074	L	54.4	Low	55.2	Low	109 Å²	109	124.1 Å²	124.1	57%	0.571	61%	0.611	S	S	*	*	H	α-helix	trans	-60.5	-40.9	175.5	-87.2	155.3	0	0	0	111.3	E1070 D1071 Y1077 S1078	E1070-L1074 PolarHBondContact O-N 2.97Å; D1071-L1074 PolarHBondContact O-N 2.87Å; L1074-Y1077 PolarHBondContact O-N 3.43Å; L1074-S1078 WeakPolarHBondContact O-CB 3.24Å; L1074-S1078 PolarHBondContact O-N 3.13Å; L1074-S1078 PolarHBondContact O-OG 3.26Å; L1074-S1078 VanDerWaalsContact O-OG 3.07Å
1075	K	56.4	Low	56.5	Low	168 Å²	168	125.7 Å²	125.7	73%	0.73	60%	0.6	S	S	*	*	H	α-helix	trans	-64	-44	175	-123.4	162.6	-173.4	161	0	113.1	D1071 F1072 K1073 K1079	D1071-K1075 PolarHBondContact O-N 3.36Å; F1072-K1075 PolarHBondContact O-N 3.23Å; K1073-K1075 VanDerWaalsContact C-N 3.3Å; K1073-K1075 PolarHBondContact O-N 2.87Å; K1075-K1079 WeakPolarHBondContact O-CB 3.22Å; K1075-K1079 PolarHBondContact O-N 3.24Å
1076	E	56.6	Low	57.6	Low	138 Å²	138	125.5 Å²	125.5	65%	0.645	59%	0.588	S	S	*	*	H	α-helix	trans	-66.7	-39.4	177.6	-168.3	167.5	-127.2	0	0	111.7	F1072 K1073 K1079 S1080	F1072-E1076 WeakPolarHBondContact O-CB 3.34Å; F1072-E1076 PolarHBondContact O-N 2.76Å; K1073-E1076 PolarHBondContact O-N 2.59Å; E1076-K1079 PolarHBondContact O-N 3.33Å; E1076-S1080 WeakPolarHBondContact O-CB 3.26Å; E1076-S1080 PolarHBondContact O-N 3.18Å
1077	Y	52	Low	58.7	Low	179 Å²	179	122.2 Å²	122.2	70%	0.702	58%	0.584	S	S	*	*	H	α-helix	trans	-69.7	-39.9	176.6	-150.1	-96.7	0	0	0	112.4	K1073 L1074 S1080 M1081	K1073-Y1077 VanDerWaalsContact O-CB 3.28Å; K1073-Y1077 WeakPolarHBondContact O-CB 3.41Å; K1073-Y1077 PolarHBondContact O-N 3.22Å; L1074-Y1077 PolarHBondContact O-N 3.43Å; Y1077-S1080 PolarHBondContact O-N 3.3Å; Y1077-M1081 WeakPolarHBondContact O-CB 3.37Å; Y1077-M1081 PolarHBondContact O-N 2.78Å
1078	S	58.9	Low	59.7	Low	70 Å²	70	124.3 Å²	124.3	49%	0.49	59%	0.585	S	S	.	*	H	α-helix	trans	-61.5	-45.4	170.7	-67.3	0	0	0	0	111.5	L1074 S1080 M1081 D1082	L1074-S1078 WeakPolarHBondContact O-CB 3.24Å; L1074-S1078 PolarHBondContact O-N 3.13Å; L1074-S1078 PolarHBondContact O-OG 3.26Å; L1074-S1078 VanDerWaalsContact O-OG 3.07Å; S1078-S1080 PolarHBondContact O-N 3.08Å; S1078-M1081 WeakPolarHBondContact O-CB 3.29Å; S1078-M1081 PolarHBondContact O-N 3.03Å; S1078-D1082 PolarHBondContact O-N 3.38Å
1079	K	58.3	Low	60.8	Low	135 Å²	135	121.5 Å²	121.5	59%	0.587	57%	0.572	S	S	*	*	H	α-helix	trans	-60.9	-45.9	177.6	-165.1	-170.7	176.9	-142.3	0	111.3	K1075 E1076 M1081 D1082 E1083	K1075-K1079 WeakPolarHBondContact O-CB 3.22Å; K1075-K1079 PolarHBondContact O-N 3.24Å; E1076-K1079 PolarHBondContact O-N 3.33Å; K1079-M1081 VanDerWaalsContact C-N 3.31Å; K1079-M1081 PolarHBondContact O-N 3.02Å; K1079-D1082 PolarHBondContact O-N 3.33Å; K1079-E1083 IonicContact NZ-OE1 2.65Å; K1079-E1083 VanDerWaalsContact O-CB 3.28Å; K1079-E1083 WeakPolarHBondContact O-CB 3.06Å; K1079-E1083 PolarHBondContact O-N 2.93Å
1080	S	63.2	Low	61.7	Low	70 Å²	70	117.8 Å²	117.8	49%	0.49	56%	0.561	S	S	.	*	H	α-helix	trans	-61.5	-35.8	176	-179.4	0	0	0	0	113.1	E1076 Y1077 S1078 S1084	E1076-S1080 WeakPolarHBondContact O-CB 3.26Å; E1076-S1080 PolarHBondContact O-N 3.18Å; Y1077-S1080 PolarHBondContact O-N 3.3Å; S1078-S1080 PolarHBondContact O-N 3.08Å; S1080-S1084 VanDerWaalsContact O-CB 3.29Å; S1080-S1084 WeakPolarHBondContact O-CB 3.48Å; S1080-S1084 PolarHBondContact O-N 2.92Å
1081	M	57.6	Low	62.7	Low	111 Å²	111	116.3 Å²	116.3	55%	0.547	56%	0.555	S	S	.	*	H	α-helix	trans	-67.3	-39.9	174.3	-89.5	-73.8	-65.4	0	0	113.3	Y1077 S1078 K1079 R1085	Y1077-M1081 WeakPolarHBondContact O-CB 3.37Å; Y1077-M1081 PolarHBondContact O-N 2.78Å; S1078-M1081 WeakPolarHBondContact O-CB 3.29Å; S1078-M1081 PolarHBondContact O-N 3.03Å; K1079-M1081 VanDerWaalsContact C-N 3.31Å; K1079-M1081 PolarHBondContact O-N 3.02Å; M1081-R1085 WeakPolarHBondContact O-CG 3.35Å; M1081-R1085 PolarHBondContact O-N 3.2Å
1082	D	63.8	Low	63.5	Low	90 Å²	90	117.8 Å²	117.8	48%	0.481	55%	0.553	S	S	.	*	H	α-helix	trans	-76	-34.7	175.8	-85.7	-39.4	0	0	0	112.6	S1078 K1079 R1085 M1086	S1078-D1082 PolarHBondContact O-N 3.38Å; K1079-D1082 PolarHBondContact O-N 3.33Å; D1082-R1085 WeakPolarHBondContact O-CB 3.45Å; D1082-R1085 PolarHBondContact O-N 3.02Å; D1082-R1085 VanDerWaalsContact O-N 3.17Å; D1082-R1085 IonicContact OD1-CZ 3.21Å; D1082-R1085 IonicContact OD1-NE 2.66Å; D1082-R1085 PolarHBondContact OD1-NE 3.03Å; D1082-M1086 WeakPolarHBondContact O-CG 3.28Å; D1082-M1086 PolarHBondContact O-N 2.79Å
1083	E	65.6	Low	64.4	Low	108 Å²	108	116.2 Å²	116.2	51%	0.505	55%	0.548	S	S	.	.	H	α-helix	trans	-62.5	-46.5	173.1	-153.9	153.7	-127.5	0	0	109.9	K1079 R1085 M1086 D1087	K1079-E1083 IonicContact NZ-OE1 2.65Å; K1079-E1083 VanDerWaalsContact O-CB 3.28Å; K1079-E1083 WeakPolarHBondContact O-CB 3.06Å; K1079-E1083 PolarHBondContact O-N 2.93Å; E1083-R1085 VanDerWaalsContact C-N 3.3Å; E1083-R1085 PolarHBondContact O-N 3.47Å; E1083-M1086 PolarHBondContact O-N 3.04Å; E1083-M1086 VanDerWaalsContact O-N 3.13Å; E1083-D1087 PolarHBondContact O-N 2.93Å
1084	S	68.3	Low	65.4	Low	52 Å²	52	113.8 Å²	113.8	36%	0.364	54%	0.539	S	S	.	.	H	α-helix	trans	-66.2	-25.9	172.6	-174.7	0	0	0	0	114.1	S1080 R1088	S1080-S1084 VanDerWaalsContact O-CB 3.29Å; S1080-S1084 WeakPolarHBondContact O-CB 3.48Å; S1080-S1084 PolarHBondContact O-N 2.92Å; S1084-R1088 WeakPolarHBondContact O-CG 3.48Å; S1084-R1088 PolarHBondContact O-N 3.36Å
1085	R	71.1	Confident	66.5	Low	141 Å²	141	110.7 Å²	110.7	53%	0.532	52%	0.522	S	S	.	.	H	α-helix	trans	-71.3	-40.7	169.8	-84.4	162.1	46.5	72.1	1.5	111.6	M1081 D1082 E1083 R1088 V1089	M1081-R1085 WeakPolarHBondContact O-CG 3.35Å; M1081-R1085 PolarHBondContact O-N 3.2Å; D1082-R1085 WeakPolarHBondContact O-CB 3.45Å; D1082-R1085 PolarHBondContact O-N 3.02Å; D1082-R1085 VanDerWaalsContact O-N 3.17Å; D1082-R1085 IonicContact OD1-CZ 3.21Å; D1082-R1085 IonicContact OD1-NE 2.66Å; D1082-R1085 PolarHBondContact OD1-NE 3.03Å; E1083-R1085 VanDerWaalsContact C-N 3.3Å; E1083-R1085 PolarHBondContact O-N 3.47Å; R1085-R1088 PolarHBondContact O-N 3.49Å; R1085-V1089 WeakPolarHBondContact O-CG2 3.48Å; R1085-V1089 PolarHBondContact O-N 3.06Å
1086	M	67.1	Low	67.7	Low	111 Å²	111	107.2 Å²	107.2	55%	0.547	51%	0.51	S	S	.	.	H	α-helix	trans	-65.8	-43.9	176.6	-68.5	-63.7	96.9	0	0	111.5	D1082 E1083 R1088 V1089 K1090	D1082-M1086 WeakPolarHBondContact O-CG 3.28Å; D1082-M1086 PolarHBondContact O-N 2.79Å; E1083-M1086 PolarHBondContact O-N 3.04Å; E1083-M1086 VanDerWaalsContact O-N 3.13Å; M1086-R1088 VanDerWaalsContact C-N 3.34Å; M1086-R1088 PolarHBondContact O-N 2.78Å; M1086-V1089 PolarHBondContact O-N 3.42Å; M1086-V1089 VanDerWaalsContact O-N 3.17Å; M1086-K1090 WeakPolarHBondContact O-CB 3.13Å; M1086-K1090 PolarHBondContact O-N 2.99Å
1087	D	71.2	Confident	68.7	Low	106 Å²	106	102.4 Å²	102.4	57%	0.567	49%	0.489	S	S	*	.	H	α-helix	trans	-60.1	-42.2	176.2	-74.7	-24.9	0	0	0	111.9	E1083 K1090 E1091	E1083-D1087 PolarHBondContact O-N 2.93Å; D1087-K1090 WeakPolarHBondContact O-CB 3.31Å; D1087-K1090 PolarHBondContact O-N 2.96Å; D1087-E1091 WeakPolarHBondContact O-CB 3.3Å; D1087-E1091 PolarHBondContact O-N 3.14Å
1088	R	73.3	Confident	69.8	Low	149 Å²	149	94.6 Å²	94.6	56%	0.562	46%	0.46	S	S	*	.	H	α-helix	trans	-68.2	-34.7	174	-75.5	-172.9	-170.8	166.8	7.9	114.1	S1084 R1085 M1086 K1090 Y1092	S1084-R1088 WeakPolarHBondContact O-CG 3.48Å; S1084-R1088 PolarHBondContact O-N 3.36Å; R1085-R1088 PolarHBondContact O-N 3.49Å; M1086-R1088 VanDerWaalsContact C-N 3.34Å; M1086-R1088 PolarHBondContact O-N 2.78Å; R1088-K1090 VanDerWaalsContact C-N 3.26Å; R1088-Y1092 WeakPolarHBondContact O-CB 3.49Å; R1088-Y1092 WeakPolarHBondContact O-CD2 3.22Å; R1088-Y1092 PolarHBondContact O-N 3.02Å
1089	V	75.1	Confident	70.6	Confident	70 Å²	70	95.5 Å²	95.5	42%	0.424	46%	0.459	S	S	.	.	H	α-helix	trans	-64.2	-38.7	173.2	166.9	0	0	0	0	109.8	R1085 M1086 Y1092 E1093	R1085-V1089 WeakPolarHBondContact O-CG2 3.48Å; R1085-V1089 PolarHBondContact O-N 3.06Å; M1086-V1089 PolarHBondContact O-N 3.42Å; M1086-V1089 VanDerWaalsContact O-N 3.17Å; V1089-Y1092 CarbonylContact O-C 3.57Å; V1089-Y1092 PolarHBondContact O-N 2.74Å; V1089-E1093 WeakPolarHBondContact O-CG 3.42Å; V1089-E1093 PolarHBondContact O-N 3.17Å
1090	K	72.1	Confident	71.5	Confident	125 Å²	125	94.5 Å²	94.5	54%	0.543	46%	0.455	S	S	.	.	H	α-helix	trans	-69.1	-42.8	176.7	-162.8	-178.7	178	-167.1	0	112.6	M1086 D1087 R1088 Y1092 E1093 E1094	M1086-K1090 WeakPolarHBondContact O-CB 3.13Å; M1086-K1090 PolarHBondContact O-N 2.99Å; D1087-K1090 WeakPolarHBondContact O-CB 3.31Å; D1087-K1090 PolarHBondContact O-N 2.96Å; R1088-K1090 VanDerWaalsContact C-N 3.26Å; K1090-Y1092 PolarHBondContact O-N 2.79Å; K1090-E1093 PolarHBondContact O-N 3.46Å; K1090-E1094 WeakPolarHBondContact O-CB 3.42Å; K1090-E1094 PolarHBondContact O-N 3.46Å
1091	E	71.1	Confident	72.3	Confident	105 Å²	105	94.6 Å²	94.6	49%	0.491	45%	0.448	S	S	.	.	H	α-helix	trans	-57.1	-37.9	169.3	-170.6	175.6	-144.2	0	0	110.9	D1087 E1095	D1087-E1091 WeakPolarHBondContact O-CB 3.3Å; D1087-E1091 PolarHBondContact O-N 3.14Å; E1091-E1095 VanDerWaalsContact O-CB 3.31Å; E1091-E1095 WeakPolarHBondContact O-CB 3.42Å; E1091-E1095 PolarHBondContact O-N 3.02Å
1092	Y	68.4	Low	73.3	Confident	133 Å²	133	95.1 Å²	95.1	52%	0.522	44%	0.444	S	S	.	.	H	α-helix	trans	-76	-32.3	174.2	-72.5	-45.8	0	0	0	114.9	R1088 V1089 K1090 E1095 I1096	R1088-Y1092 WeakPolarHBondContact O-CB 3.49Å; R1088-Y1092 WeakPolarHBondContact O-CD2 3.22Å; R1088-Y1092 PolarHBondContact O-N 3.02Å; V1089-Y1092 CarbonylContact O-C 3.57Å; V1089-Y1092 PolarHBondContact O-N 2.74Å; K1090-Y1092 PolarHBondContact O-N 2.79Å; Y1092-E1095 HydrophobicContact CD1-CB 4.4Å; Y1092-E1095 WeakPolarHBondContact CD1-OE2 3.39Å; Y1092-E1095 VanDerWaalsContact CE1-OE2 3.26Å; Y1092-E1095 WeakPolarHBondContact CE1-OE2 3.48Å; Y1092-E1095 PolarHBondContact O-N 3.39Å; Y1092-I1096 WeakPolarHBondContact O-CB 3.25Å; Y1092-I1096 VanDerWaalsContact O-CG1 3.3Å; Y1092-I1096 WeakPolarHBondContact O-CG1 3.35Å; Y1092-I1096 PolarHBondContact O-N 3.37Å
1093	E	73.6	Confident	74.1	Confident	129 Å²	129	96.5 Å²	96.5	60%	0.603	45%	0.45	S	S	*	.	H	α-helix	trans	-71.1	-33.3	173.4	-77.3	-170.4	151.3	0	0	111.6	V1089 K1090 N1097	V1089-E1093 WeakPolarHBondContact O-CG 3.42Å; V1089-E1093 PolarHBondContact O-N 3.17Å; K1090-E1093 PolarHBondContact O-N 3.46Å; E1093-N1097 PolarHBondContact O-ND2 3.16Å
1094	E	75.6	Confident	75.1	Confident	91 Å²	91	97.1 Å²	97.1	43%	0.425	46%	0.457	S	S	.	.	H	α-helix	trans	-63.2	-53.8	162.6	-74.4	175.8	-149.6	0	0	109.5	D887 K1090 I1096 N1097	D887-E1094 CarbonylContact C-O 3.37Å; D887-E1094 WeakPolarHBondContact CB-O 3.39Å; D887-E1094 WeakPolarHBondContact O-CB 3.27Å; K1090-E1094 WeakPolarHBondContact O-CB 3.42Å; K1090-E1094 PolarHBondContact O-N 3.46Å; E1094-I1096 PolarHBondContact O-N 3.17Å; E1094-N1097 VanDerWaalsContact O-CA 3.28Å; E1094-N1097 WeakPolarHBondContact O-CA 3.36Å; E1094-N1097 PolarHBondContact O-N 2.99Å
1095	E	77.8	Confident	75.4	Confident	44 Å²	44	99.4 Å²	99.4	21%	0.206	46%	0.462	C	S	.	.	H	α-helix	trans	-53.6	-27.8	178.6	179.7	152.1	-136.1	0	0	115	M885 Q886 E1091 Y1092 L1099	M885-E1095 WeakPolarHBondContact CB-OE1 3.32Å; Q886-E1095 HydrophobicContact CB-CB 4.07Å; Q886-E1095 HydrophobicContact CB-CG 3.86Å; Q886-E1095 HydrophobicContact CG-CB 4.43Å; Q886-E1095 HydrophobicContact CG-CG 3.96Å; Q886-E1095 PolarHBondContact NE2-OE1 2.94Å; E1091-E1095 VanDerWaalsContact O-CB 3.31Å; E1091-E1095 WeakPolarHBondContact O-CB 3.42Å; E1091-E1095 PolarHBondContact O-N 3.02Å; Y1092-E1095 HydrophobicContact CD1-CB 4.4Å; Y1092-E1095 WeakPolarHBondContact CD1-OE2 3.39Å; Y1092-E1095 VanDerWaalsContact CE1-OE2 3.26Å; Y1092-E1095 WeakPolarHBondContact CE1-OE2 3.48Å; Y1092-E1095 PolarHBondContact O-N 3.39Å; E1095-L1099 WeakPolarHBondContact O-CD1 3.3Å
1096	I	80.4	Confident	75.6	Confident	95 Å²	95	96.1 Å²	96.1	49%	0.487	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-15.1	177.3	-74.7	166.7	0	0	0	112.3	Y1092 E1094 K1100	Y1092-I1096 WeakPolarHBondContact O-CB 3.25Å; Y1092-I1096 VanDerWaalsContact O-CG1 3.3Å; Y1092-I1096 WeakPolarHBondContact O-CG1 3.35Å; Y1092-I1096 PolarHBondContact O-N 3.37Å; E1094-I1096 PolarHBondContact O-N 3.17Å; I1096-K1100 WeakPolarHBondContact O-CE 3.49Å; I1096-K1100 WeakPolarHBondContact O-CG 3.32Å
1097	N	78.1	Confident	76.3	Confident	37 Å²	37	96 Å²	96	20%	0.198	46%	0.459	C	S	.	.	H	α-helix	trans	-53	-84.4	172.4	39.3	-114.7	0	0	0	116.4	N888 L889 E1093 E1094 L1099 K1100 E1101	N888-N1097 HydrophobicContact CB-CB 3.75Å; N888-N1097 PolarHBondContact ND2-O 3.34Å; N888-N1097 PolarHBondContact O-ND2 2.93Å; N888-N1097 VanDerWaalsContact O-ND2 3.13Å; L889-N1097 HydrophobicContact CB-CB 4.43Å; L889-N1097 HydrophobicContact CD1-CB 4.41Å; E1093-N1097 PolarHBondContact O-ND2 3.16Å; E1094-N1097 VanDerWaalsContact O-CA 3.28Å; E1094-N1097 WeakPolarHBondContact O-CA 3.36Å; E1094-N1097 PolarHBondContact O-N 2.99Å; N1097-L1099 VanDerWaalsContact C-N 3.26Å; N1097-L1099 PolarHBondContact O-N 3.25Å; N1097-K1100 HydrophobicContact CB-CD 4.19Å; N1097-K1100 WeakPolarHBondContact O-CA 3.16Å; N1097-K1100 WeakPolarHBondContact O-CB 3.33Å; N1097-K1100 PolarHBondContact O-N 2.88Å; N1097-K1100 PolarHBondContact OD1-NZ 3.32Å; N1097-E1101 PolarHBondContact O-N 3.22Å
1098	S	76.3	Confident	77	Confident	14 Å²	14	99.5 Å²	99.5	10%	0.098	46%	0.464	C	S	.	.	H	α-helix	trans	-87	-0.4	-163.9	116.2	0	0	0	0	112	D887 N888 E1101 R1102	D887-S1098 VanDerWaalsContact CG-CA 3.44Å; D887-S1098 WeakPolarHBondContact OD1-CB 3.25Å; D887-S1098 PolarHBondContact OD1-OG 3.35Å; D887-S1098 WeakPolarHBondContact OD2-CA 3.34Å; D887-S1098 WeakPolarHBondContact OD2-CB 3.26Å; D887-S1098 PolarHBondContact OD2-N 2.82Å; D887-S1098 PolarHBondContact OD2-OG 3.36Å; N888-S1098 VanDerWaalsContact CB-N 3.3Å; N888-S1098 VanDerWaalsContact CG-CA 3.44Å; N888-S1098 WeakPolarHBondContact ND2-CA 3.31Å; N888-S1098 WeakPolarHBondContact OD1-CB 3.43Å; S1098-E1101 PolarHBondContact O-N 2.9Å; S1098-R1102 WeakPolarHBondContact O-CA 3.47Å; S1098-R1102 WeakPolarHBondContact O-CB 3.19Å; S1098-R1102 WeakPolarHBondContact O-CG 3.42Å; S1098-R1102 PolarHBondContact O-N 3.2Å; S1098-R1102 PolarHBondContact O-NE 2.96Å; S1098-R1102 PolarHBondContact OG-NE 3.45Å; S1098-R1102 PolarHBondContact OG-NH2 3.02Å
1099	L	74.9	Confident	77.6	Confident	89 Å²	89	97.4 Å²	97.4	47%	0.466	46%	0.459	S	S	.	.	H	α-helix	trans	-54.8	-45	149.4	-69.5	178.2	0	0	0	110.2	D887 E1095 N1097 L1103	D887-L1099 PolarHBondContact OD2-N 3.08Å; E1095-L1099 WeakPolarHBondContact O-CD1 3.3Å; N1097-L1099 VanDerWaalsContact C-N 3.26Å; N1097-L1099 PolarHBondContact O-N 3.25Å; L1099-L1103 WeakPolarHBondContact O-CB 3.33Å; L1099-L1103 PolarHBondContact O-N 2.94Å
1100	K	77.9	Confident	77.8	Confident	115 Å²	115	98.4 Å²	98.4	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-68.9	-38.8	175.8	-56	168.7	-164.6	158.7	0	112.3	I1096 N1097 L1104	I1096-K1100 WeakPolarHBondContact O-CE 3.49Å; I1096-K1100 WeakPolarHBondContact O-CG 3.32Å; N1097-K1100 HydrophobicContact CB-CD 4.19Å; N1097-K1100 WeakPolarHBondContact O-CA 3.16Å; N1097-K1100 WeakPolarHBondContact O-CB 3.33Å; N1097-K1100 PolarHBondContact O-N 2.88Å; N1097-K1100 PolarHBondContact OD1-NZ 3.32Å; K1100-L1104 VanDerWaalsContact O-CB 3.31Å; K1100-L1104 WeakPolarHBondContact O-CB 3.29Å; K1100-L1104 PolarHBondContact O-N 2.88Å
1101	E	78.6	Confident	78.3	Confident	71 Å²	71	95.7 Å²	95.7	33%	0.332	45%	0.451	S	S	.	.	H	α-helix	trans	-79.8	-36.4	179.4	-175.8	169	-68.7	0	0	113.9	N888 Q890 N1097 S1098 L1103 L1104 M1105	N888-E1101 WeakPolarHBondContact ND2-CB 3.43Å; N888-E1101 PolarHBondContact ND2-OE1 3.18Å; Q890-E1101 PolarHBondContact NE2-OE1 2.93Å; N1097-E1101 PolarHBondContact O-N 3.22Å; S1098-E1101 PolarHBondContact O-N 2.9Å; E1101-L1103 VanDerWaalsContact C-N 3.3Å; E1101-L1103 PolarHBondContact O-N 3.45Å; E1101-L1104 PolarHBondContact O-N 3.14Å; E1101-M1105 HydrophobicContact CG-CG 4.38Å; E1101-M1105 VanDerWaalsContact O-CB 3.27Å; E1101-M1105 WeakPolarHBondContact O-CB 3.46Å; E1101-M1105 VanDerWaalsContact O-CG 3.26Å; E1101-M1105 WeakPolarHBondContact O-CG 3.4Å; E1101-M1105 PolarHBondContact O-N 3.15Å
1102	R	79.1	Confident	78.8	Confident	123 Å²	123	94.9 Å²	94.9	46%	0.464	45%	0.447	S	S	.	.	H	α-helix	trans	-64.4	-36	167.2	-74.9	175.8	-85.9	164	-5.3	111.1	D887 S1098 S1106	D887-R1102 IonicContact OD1-NH2 2.78Å; D887-R1102 PolarHBondContact OD1-NH2 2.85Å; D887-R1102 IonicContact OD2-CZ 3.07Å; D887-R1102 IonicContact OD2-NH2 2.77Å; D887-R1102 PolarHBondContact OD2-NH2 2.89Å; S1098-R1102 WeakPolarHBondContact O-CA 3.47Å; S1098-R1102 WeakPolarHBondContact O-CB 3.19Å; S1098-R1102 WeakPolarHBondContact O-CG 3.42Å; S1098-R1102 PolarHBondContact O-N 3.2Å; S1098-R1102 PolarHBondContact O-NE 2.96Å; S1098-R1102 PolarHBondContact OG-NE 3.45Å; S1098-R1102 PolarHBondContact OG-NH2 3.02Å; R1102-S1106 WeakPolarHBondContact O-CB 3.48Å; R1102-S1106 PolarHBondContact O-N 3.35Å
1103	L	81.6	Confident	79.1	Confident	119 Å²	119	94.4 Å²	94.4	62%	0.623	45%	0.446	S	S	*	.	H	α-helix	trans	-64	-45.8	170.4	-178.2	64.4	0	0	0	111.5	L1099 E1101 S1106 H1107	L1099-L1103 WeakPolarHBondContact O-CB 3.33Å; L1099-L1103 PolarHBondContact O-N 2.94Å; E1101-L1103 VanDerWaalsContact C-N 3.3Å; E1101-L1103 PolarHBondContact O-N 3.45Å; L1103-S1106 WeakPolarHBondContact O-CB 3.5Å; L1103-S1106 PolarHBondContact O-N 2.66Å; L1103-H1107 WeakPolarHBondContact O-CB 3.47Å; L1103-H1107 PolarHBondContact O-N 3.4Å
1104	L	85.9	Confident	79.5	Confident	121 Å²	121	93.5 Å²	93.5	63%	0.634	44%	0.441	S	S	*	.	H	α-helix	trans	-63.2	-42.9	177.6	-161.9	80.7	0	0	0	112.2	K1100 E1101 H1107 R1108	K1100-L1104 VanDerWaalsContact O-CB 3.31Å; K1100-L1104 WeakPolarHBondContact O-CB 3.29Å; K1100-L1104 PolarHBondContact O-N 2.88Å; E1101-L1104 PolarHBondContact O-N 3.14Å; L1104-H1107 PolarHBondContact O-N 3.12Å; L1104-R1108 WeakPolarHBondContact O-CB 3.38Å; L1104-R1108 PolarHBondContact O-N 2.98Å
1105	M	73.4	Confident	80.1	Confident	99 Å²	99	96.1 Å²	96.1	49%	0.488	45%	0.447	S	S	.	.	H	α-helix	trans	-69	-34.9	176.2	-73.4	-68.2	-78.4	0	0	112	E1101 K1109	E1101-M1105 HydrophobicContact CG-CG 4.38Å; E1101-M1105 VanDerWaalsContact O-CB 3.27Å; E1101-M1105 WeakPolarHBondContact O-CB 3.46Å; E1101-M1105 VanDerWaalsContact O-CG 3.26Å; E1101-M1105 WeakPolarHBondContact O-CG 3.4Å; E1101-M1105 PolarHBondContact O-N 3.15Å; M1105-K1109 WeakPolarHBondContact O-CB 3.12Å; M1105-K1109 WeakPolarHBondContact O-CG 3.4Å; M1105-K1109 PolarHBondContact O-N 3.24Å
1106	S	75.8	Confident	80.5	Confident	73 Å²	73	100.7 Å²	100.7	51%	0.51	46%	0.463	S	S	.	.	H	α-helix	trans	-64.7	-43.2	170.2	-170.2	0	0	0	0	111.2	R1102 L1103 K1109 L1110	R1102-S1106 WeakPolarHBondContact O-CB 3.48Å; R1102-S1106 PolarHBondContact O-N 3.35Å; L1103-S1106 WeakPolarHBondContact O-CB 3.5Å; L1103-S1106 PolarHBondContact O-N 2.66Å; S1106-K1109 PolarHBondContact O-N 3.45Å; S1106-L1110 WeakPolarHBondContact O-CB 3.41Å; S1106-L1110 PolarHBondContact O-N 3.08Å
1107	H	82.2	Confident	80.7	Confident	108 Å²	108	101.6 Å²	101.6	50%	0.5	47%	0.468	S	S	.	.	H	α-helix	trans	-64.6	-42.4	177	-154.7	-64.6	0	0	0	112.1	L1103 L1104 L1110 E1111	L1103-H1107 WeakPolarHBondContact O-CB 3.47Å; L1103-H1107 PolarHBondContact O-N 3.4Å; L1104-H1107 PolarHBondContact O-N 3.12Å; H1107-L1110 WeakPolarHBondContact O-CB 3.33Å; H1107-L1110 PolarHBondContact O-N 2.86Å; H1107-E1111 IonicContact ND1-OE1 2.65Å; H1107-E1111 PolarHBondContact O-N 3.18Å
1108	R	87	Confident	81	Confident	179 Å²	179	104.3 Å²	104.3	68%	0.675	48%	0.482	S	S	*	.	H	α-helix	trans	-63.7	-40.5	173.9	-180	177.1	-82.4	-176.6	-5.3	112	L1104 E1112	L1104-R1108 WeakPolarHBondContact O-CB 3.38Å; L1104-R1108 PolarHBondContact O-N 2.98Å; R1108-E1112 PolarHBondContact O-N 3.21Å
1109	K	84.6	Confident	81.5	Confident	105 Å²	105	109.1 Å²	109.1	46%	0.457	50%	0.504	S	S	.	.	H	α-helix	trans	-63.7	-41.1	172.7	-80.2	-175.4	175.5	-173.8	0	111.8	M1105 S1106 E1112 Y1113	M1105-K1109 WeakPolarHBondContact O-CB 3.12Å; M1105-K1109 WeakPolarHBondContact O-CG 3.4Å; M1105-K1109 PolarHBondContact O-N 3.24Å; S1106-K1109 PolarHBondContact O-N 3.45Å; K1109-E1112 WeakPolarHBondContact O-CB 3.1Å; K1109-E1112 PolarHBondContact O-N 3.43Å; K1109-E1112 VanDerWaalsContact O-N 3.13Å; K1109-Y1113 HydrophobicContact CB-CE2 4.24Å; K1109-Y1113 WeakPolarHBondContact O-CD2 3.33Å; K1109-Y1113 PolarHBondContact O-N 3.15Å
1110	L	80.1	Confident	81.7	Confident	92 Å²	92	110.9 Å²	110.9	48%	0.482	51%	0.51	S	S	.	.	H	α-helix	trans	-60	-50.4	178.2	-177.1	62.1	0	0	0	111.3	S1106 H1107 E1112 Y1113 E1114	S1106-L1110 WeakPolarHBondContact O-CB 3.41Å; S1106-L1110 PolarHBondContact O-N 3.08Å; H1107-L1110 WeakPolarHBondContact O-CB 3.33Å; H1107-L1110 PolarHBondContact O-N 2.86Å; L1110-E1112 PolarHBondContact O-N 2.83Å; L1110-Y1113 PolarHBondContact O-N 3.4Å; L1110-Y1113 VanDerWaalsContact O-N 3.12Å; L1110-E1114 WeakPolarHBondContact O-CG 3.48Å; L1110-E1114 PolarHBondContact O-N 2.82Å
1111	E	82	Confident	82.1	Confident	68 Å²	68	110.8 Å²	110.8	32%	0.318	51%	0.511	S	S	.	.	H	α-helix	trans	-58.9	-32	174.8	-66.5	179.9	-149	0	0	112.8	H1107 R1115	H1107-E1111 IonicContact ND1-OE1 2.65Å; H1107-E1111 PolarHBondContact O-N 3.18Å; E1111-R1115 VanDerWaalsContact CB-NH1 3.28Å; E1111-R1115 WeakPolarHBondContact O-CB 3.2Å; E1111-R1115 VanDerWaalsContact O-CG 3.27Å; E1111-R1115 WeakPolarHBondContact O-CG 3.33Å; E1111-R1115 PolarHBondContact O-N 3Å; E1111-R1115 IonicContact OE2-CZ 2.7Å; E1111-R1115 VanDerWaalsContact OE2-CZ 3.24Å; E1111-R1115 IonicContact OE2-NH1 2.68Å; E1111-R1115 PolarHBondContact OE2-NH1 2.83Å; E1111-R1115 IonicContact OE2-NH2 3.67Å; E1111-R1115 PolarHBondContact OE2-NH2 2.91Å
1112	E	82.6	Confident	82.6	Confident	88 Å²	88	113.4 Å²	113.4	41%	0.411	52%	0.523	S	S	.	.	H	α-helix	trans	-71.4	-40.4	177.1	-151.5	-161.3	142.7	0	0	111.7	R1108 K1109 L1110 R1115 R1116	R1108-E1112 PolarHBondContact O-N 3.21Å; K1109-E1112 WeakPolarHBondContact O-CB 3.1Å; K1109-E1112 PolarHBondContact O-N 3.43Å; K1109-E1112 VanDerWaalsContact O-N 3.13Å; L1110-E1112 PolarHBondContact O-N 2.83Å; E1112-R1115 PolarHBondContact O-N 2.94Å; E1112-R1116 WeakPolarHBondContact O-CB 3.44Å; E1112-R1116 WeakPolarHBondContact O-CD 3.39Å; E1112-R1116 WeakPolarHBondContact O-CG 3.23Å; E1112-R1116 PolarHBondContact O-N 2.95Å; E1112-R1116 IonicContact OE1-CZ 2.7Å; E1112-R1116 IonicContact OE1-NE 3.99Å; E1112-R1116 PolarHBondContact OE1-NE 3.25Å; E1112-R1116 IonicContact OE1-NH2 3.72Å; E1112-R1116 PolarHBondContact OE1-NH2 2.78Å
1113	Y	74.5	Confident	82.8	Confident	123 Å²	123	113.7 Å²	113.7	48%	0.482	53%	0.53	S	S	.	.	H	α-helix	trans	-64	-39.8	171.6	-70	-60.1	0	0	0	112	K1109 L1110 R1116 L1117	K1109-Y1113 HydrophobicContact CB-CE2 4.24Å; K1109-Y1113 WeakPolarHBondContact O-CD2 3.33Å; K1109-Y1113 PolarHBondContact O-N 3.15Å; L1110-Y1113 PolarHBondContact O-N 3.4Å; L1110-Y1113 VanDerWaalsContact O-N 3.12Å; Y1113-R1116 PolarHBondContact O-N 2.74Å; Y1113-L1117 WeakPolarHBondContact O-CB 3.45Å; Y1113-L1117 PolarHBondContact O-N 3.33Å
1114	E	82.2	Confident	82.8	Confident	110 Å²	110	111.8 Å²	111.8	51%	0.514	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-46.5	174.1	-71.5	174.9	165.6	0	0	111.8	L1110 R1116 L1117 L1118	L1110-E1114 WeakPolarHBondContact O-CG 3.48Å; L1110-E1114 PolarHBondContact O-N 2.82Å; E1114-R1116 VanDerWaalsContact C-N 3.35Å; E1114-R1116 PolarHBondContact O-N 3.44Å; E1114-L1117 PolarHBondContact O-N 3.49Å; E1114-L1118 WeakPolarHBondContact O-CB 3.37Å; E1114-L1118 PolarHBondContact O-N 3.43Å
1115	R	87.6	Confident	82.8	Confident	146 Å²	146	110 Å²	110	55%	0.551	52%	0.515	S	S	*	.	H	α-helix	trans	-60.9	-41.6	174.8	-73.1	174.3	-172.8	109.2	7.4	112.1	E1111 E1112 M1119	E1111-R1115 VanDerWaalsContact CB-NH1 3.28Å; E1111-R1115 WeakPolarHBondContact O-CB 3.2Å; E1111-R1115 VanDerWaalsContact O-CG 3.27Å; E1111-R1115 WeakPolarHBondContact O-CG 3.33Å; E1111-R1115 PolarHBondContact O-N 3Å; E1111-R1115 IonicContact OE2-CZ 2.7Å; E1111-R1115 VanDerWaalsContact OE2-CZ 3.24Å; E1111-R1115 IonicContact OE2-NH1 2.68Å; E1111-R1115 PolarHBondContact OE2-NH1 2.83Å; E1111-R1115 IonicContact OE2-NH2 3.67Å; E1111-R1115 PolarHBondContact OE2-NH2 2.91Å; E1112-R1115 PolarHBondContact O-N 2.94Å; R1115-M1119 WeakPolarHBondContact O-CG 3.45Å; R1115-M1119 PolarHBondContact O-N 3.44Å; R1115-M1119 VanDerWaalsContact O-N 3.15Å
1116	R	86.6	Confident	83.6	Confident	140 Å²	140	112.2 Å²	112.2	53%	0.528	52%	0.522	S	S	.	.	H	α-helix	trans	-64.3	-44.7	176.4	-72.1	166.4	179.5	-134.9	7.8	111.6	E1112 Y1113 E1114 M1119 Q1120	E1112-R1116 WeakPolarHBondContact O-CB 3.44Å; E1112-R1116 WeakPolarHBondContact O-CD 3.39Å; E1112-R1116 WeakPolarHBondContact O-CG 3.23Å; E1112-R1116 PolarHBondContact O-N 2.95Å; E1112-R1116 IonicContact OE1-CZ 2.7Å; E1112-R1116 IonicContact OE1-NE 3.99Å; E1112-R1116 PolarHBondContact OE1-NE 3.25Å; E1112-R1116 IonicContact OE1-NH2 3.72Å; E1112-R1116 PolarHBondContact OE1-NH2 2.78Å; Y1113-R1116 PolarHBondContact O-N 2.74Å; E1114-R1116 VanDerWaalsContact C-N 3.35Å; E1114-R1116 PolarHBondContact O-N 3.44Å; R1116-M1119 PolarHBondContact O-N 3Å; R1116-Q1120 PolarHBondContact O-N 2.92Å
1117	L	83.3	Confident	84.3	Confident	113 Å²	113	112.4 Å²	112.4	59%	0.592	52%	0.516	S	S	*	.	H	α-helix	trans	-61.6	-45.3	177.3	-179.2	63.1	0	0	0	111.6	Y1113 E1114 M1119 Q1120 E1121	Y1113-L1117 WeakPolarHBondContact O-CB 3.45Å; Y1113-L1117 PolarHBondContact O-N 3.33Å; E1114-L1117 PolarHBondContact O-N 3.49Å; L1117-M1119 VanDerWaalsContact C-N 3.34Å; L1117-M1119 PolarHBondContact O-N 2.7Å; L1117-Q1120 WeakPolarHBondContact O-CB 3.35Å; L1117-Q1120 PolarHBondContact O-N 3.3Å; L1117-Q1120 VanDerWaalsContact O-N 3.13Å; L1117-E1121 PolarHBondContact O-N 3.22Å
1118	L	84.3	Confident	84.4	Confident	94 Å²	94	112.7 Å²	112.7	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-66.7	-33.9	-179	-162.2	151.3	0	0	0	112	E1114 Q1122	E1114-L1118 WeakPolarHBondContact O-CB 3.37Å; E1114-L1118 PolarHBondContact O-N 3.43Å; L1118-Q1122 HydrophobicContact CD2-CG 4.47Å; L1118-Q1122 WeakPolarHBondContact O-CG 3.44Å; L1118-Q1122 PolarHBondContact O-N 3.36Å
1119	M	86.8	Confident	84.4	Confident	116 Å²	116	108.9 Å²	108.9	57%	0.571	51%	0.513	S	S	*	.	H	α-helix	trans	-66.5	-41.8	169.5	-72.2	-173.1	-68.8	0	0	112.5	R1115 R1116 L1117 E1121 Q1122 Q1123	R1115-M1119 WeakPolarHBondContact O-CG 3.45Å; R1115-M1119 PolarHBondContact O-N 3.44Å; R1115-M1119 VanDerWaalsContact O-N 3.15Å; R1116-M1119 PolarHBondContact O-N 3Å; L1117-M1119 VanDerWaalsContact C-N 3.34Å; L1117-M1119 PolarHBondContact O-N 2.7Å; M1119-E1121 VanDerWaalsContact C-N 3.33Å; M1119-E1121 PolarHBondContact O-N 2.85Å; M1119-Q1122 PolarHBondContact O-N 3.46Å; M1119-Q1123 PolarHBondContact O-N 2.76Å
1120	Q	79.6	Confident	84.5	Confident	125 Å²	125	109.3 Å²	109.3	58%	0.584	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-37.9	175.7	-177.2	177.7	-12.5	0	0	111.9	R1116 L1117 Q1123 T1124	R1116-Q1120 PolarHBondContact O-N 2.92Å; L1117-Q1120 WeakPolarHBondContact O-CB 3.35Å; L1117-Q1120 PolarHBondContact O-N 3.3Å; L1117-Q1120 VanDerWaalsContact O-N 3.13Å; Q1120-Q1123 PolarHBondContact O-N 2.83Å; Q1120-T1124 WeakPolarHBondContact O-CB 3.41Å; Q1120-T1124 PolarHBondContact O-N 3.15Å; Q1120-T1124 PolarHBondContact O-OG1 3.43Å
1121	E	86.8	Confident	84.7	Confident	113 Å²	113	111.6 Å²	111.6	53%	0.528	52%	0.52	S	S	.	.	H	α-helix	trans	-64.6	-45.8	174.9	-162.1	-160.6	151.6	0	0	111.5	L1117 M1119 Q1123 T1124 N1125	L1117-E1121 PolarHBondContact O-N 3.22Å; M1119-E1121 VanDerWaalsContact C-N 3.33Å; M1119-E1121 PolarHBondContact O-N 2.85Å; E1121-Q1123 VanDerWaalsContact C-N 3.34Å; E1121-Q1123 PolarHBondContact O-N 2.89Å; E1121-T1124 PolarHBondContact O-N 2.72Å; E1121-N1125 WeakPolarHBondContact O-CB 3.33Å; E1121-N1125 PolarHBondContact O-N 3.06Å; E1121-N1125 PolarHBondContact O-ND2 3.13Å
1122	Q	88.9	Confident	84.7	Confident	126 Å²	126	113.3 Å²	113.3	59%	0.589	53%	0.528	S	S	*	.	H	α-helix	trans	-60.8	-41.4	174.7	-74.2	-176.3	14.8	0	0	112.3	L1118 M1119 K1126	L1118-Q1122 HydrophobicContact CD2-CG 4.47Å; L1118-Q1122 WeakPolarHBondContact O-CG 3.44Å; L1118-Q1122 PolarHBondContact O-N 3.36Å; M1119-Q1122 PolarHBondContact O-N 3.46Å; Q1122-K1126 WeakPolarHBondContact O-CB 3.48Å; Q1122-K1126 PolarHBondContact O-N 2.83Å
1123	Q	82	Confident	85.1	Confident	129 Å²	129	113.3 Å²	113.3	60%	0.603	53%	0.531	S	S	*	.	H	α-helix	trans	-62.9	-41.8	174.5	-177.7	172.8	-11	0	0	111.7	M1119 Q1120 E1121 K1126 I1127	M1119-Q1123 PolarHBondContact O-N 2.76Å; Q1120-Q1123 PolarHBondContact O-N 2.83Å; E1121-Q1123 VanDerWaalsContact C-N 3.34Å; E1121-Q1123 PolarHBondContact O-N 2.89Å; Q1123-K1126 PolarHBondContact O-N 3.38Å; Q1123-I1127 HydrophobicContact CG-CD1 4.18Å; Q1123-I1127 WeakPolarHBondContact O-CG1 3.36Å; Q1123-I1127 PolarHBondContact O-N 3.32Å
1124	T	83.3	Confident	85.8	Confident	80 Å²	80	114.9 Å²	114.9	49%	0.491	54%	0.536	S	S	.	.	H	α-helix	trans	-65	-47.2	178.4	-57.1	0	0	0	0	111.3	Q1120 E1121 K1126 I1127 L1128	Q1120-T1124 WeakPolarHBondContact O-CB 3.41Å; Q1120-T1124 PolarHBondContact O-N 3.15Å; Q1120-T1124 PolarHBondContact O-OG1 3.43Å; E1121-T1124 PolarHBondContact O-N 2.72Å; T1124-K1126 VanDerWaalsContact C-N 3.32Å; T1124-K1126 PolarHBondContact O-N 2.7Å; T1124-I1127 PolarHBondContact O-N 3.27Å; T1124-L1128 PolarHBondContact O-N 3.35Å
1125	N	85.8	Confident	86	Confident	84 Å²	84	115.6 Å²	115.6	45%	0.449	54%	0.543	S	S	.	.	H	α-helix	trans	-60.5	-38.9	175.2	-82	-51	0	0	0	112.4	E1121 L1128 L1129	E1121-N1125 WeakPolarHBondContact O-CB 3.33Å; E1121-N1125 PolarHBondContact O-N 3.06Å; E1121-N1125 PolarHBondContact O-ND2 3.13Å; N1125-L1128 PolarHBondContact O-N 2.61Å; N1125-L1129 WeakPolarHBondContact O-CB 3.32Å; N1125-L1129 PolarHBondContact O-N 3.07Å
1126	K	89.9	Confident	86	Confident	145 Å²	145	111.8 Å²	111.8	63%	0.63	53%	0.531	S	S	*	.	H	α-helix	trans	-63.2	-40.1	174.8	-173.6	176.8	-178.4	178.6	0	112.4	Q1122 Q1123 T1124 Q1130	Q1122-K1126 WeakPolarHBondContact O-CB 3.48Å; Q1122-K1126 PolarHBondContact O-N 2.83Å; Q1123-K1126 PolarHBondContact O-N 3.38Å; T1124-K1126 VanDerWaalsContact C-N 3.32Å; T1124-K1126 PolarHBondContact O-N 2.7Å; K1126-Q1130 WeakPolarHBondContact O-CG 3.36Å; K1126-Q1130 PolarHBondContact O-N 3.25Å; K1126-Q1130 VanDerWaalsContact O-N 3.15Å
1127	I	90.4	Very high	86.2	Confident	76 Å²	76	108.9 Å²	108.9	39%	0.39	53%	0.526	S	S	.	.	H	α-helix	trans	-67.6	-43	174.7	-69	165.1	0	0	0	110.5	Q1123 T1124 L1129 Q1130 Y1131	Q1123-I1127 HydrophobicContact CG-CD1 4.18Å; Q1123-I1127 WeakPolarHBondContact O-CG1 3.36Å; Q1123-I1127 PolarHBondContact O-N 3.32Å; T1124-I1127 PolarHBondContact O-N 3.27Å; I1127-L1129 VanDerWaalsContact C-N 3.34Å; I1127-L1129 PolarHBondContact O-N 3.35Å; I1127-Q1130 WeakPolarHBondContact O-CB 3.01Å; I1127-Q1130 PolarHBondContact O-N 3.4Å; I1127-Q1130 VanDerWaalsContact O-N 3.14Å; I1127-Y1131 HydrophobicContact CG2-CD2 3.81Å; I1127-Y1131 HydrophobicContact CG2-CE2 3.79Å; I1127-Y1131 WeakPolarHBondContact O-CD2 3.39Å; I1127-Y1131 PolarHBondContact O-N 2.9Å
1128	L	83.2	Confident	86.4	Confident	114 Å²	114	106.2 Å²	106.2	60%	0.597	52%	0.517	S	S	*	.	H	α-helix	trans	-58.6	-45.4	177.7	-156.5	80.1	0	0	0	111.5	T1124 N1125 Q1130 Y1131 Q1132	T1124-L1128 PolarHBondContact O-N 3.35Å; N1125-L1128 PolarHBondContact O-N 2.61Å; L1128-Q1130 VanDerWaalsContact C-N 3.33Å; L1128-Q1130 PolarHBondContact O-N 3.42Å; L1128-Y1131 WeakPolarHBondContact O-CB 3.18Å; L1128-Y1131 PolarHBondContact O-N 3.38Å; L1128-Y1131 VanDerWaalsContact O-N 3.15Å; L1128-Q1132 PolarHBondContact O-N 2.97Å
1129	L	88.2	Confident	86.7	Confident	99 Å²	99	106 Å²	106	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-33.4	176.7	-169.8	66.4	0	0	0	112.5	N1125 I1127 N1133	N1125-L1129 WeakPolarHBondContact O-CB 3.32Å; N1125-L1129 PolarHBondContact O-N 3.07Å; I1127-L1129 VanDerWaalsContact C-N 3.34Å; I1127-L1129 PolarHBondContact O-N 3.35Å; L1129-N1133 WeakPolarHBondContact O-CB 3.42Å; L1129-N1133 PolarHBondContact O-N 3.29Å; L1129-N1133 PolarHBondContact O-ND2 3.33Å
1130	Q	85.9	Confident	86.9	Confident	115 Å²	115	107.9 Å²	107.9	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-37.3	171.7	-75.4	-179.9	-15.1	0	0	112.3	K1126 I1127 L1128 R1134	K1126-Q1130 WeakPolarHBondContact O-CG 3.36Å; K1126-Q1130 PolarHBondContact O-N 3.25Å; K1126-Q1130 VanDerWaalsContact O-N 3.15Å; I1127-Q1130 WeakPolarHBondContact O-CB 3.01Å; I1127-Q1130 PolarHBondContact O-N 3.4Å; I1127-Q1130 VanDerWaalsContact O-N 3.14Å; L1128-Q1130 VanDerWaalsContact C-N 3.33Å; L1128-Q1130 PolarHBondContact O-N 3.42Å; Q1130-R1134 WeakPolarHBondContact O-CB 3.49Å; Q1130-R1134 WeakPolarHBondContact O-CG 3.39Å; Q1130-R1134 PolarHBondContact O-N 2.98Å
1131	Y	83.9	Confident	87.3	Confident	139 Å²	139	108.1 Å²	108.1	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-66.7	-42.9	172.6	-87.9	-75.2	0	0	0	112.3	I1127 L1128 R1134 L1135	I1127-Y1131 HydrophobicContact CG2-CD2 3.81Å; I1127-Y1131 HydrophobicContact CG2-CE2 3.79Å; I1127-Y1131 WeakPolarHBondContact O-CD2 3.39Å; I1127-Y1131 PolarHBondContact O-N 2.9Å; L1128-Y1131 WeakPolarHBondContact O-CB 3.18Å; L1128-Y1131 PolarHBondContact O-N 3.38Å; L1128-Y1131 VanDerWaalsContact O-N 3.15Å; Y1131-R1134 VanDerWaalsContact CE1-NH1 3.32Å; Y1131-R1134 PolarHBondContact O-N 3.46Å; Y1131-L1135 WeakPolarHBondContact O-CB 3.49Å; Y1131-L1135 PolarHBondContact O-N 2.91Å
1132	Q	83.6	Confident	87.4	Confident	104 Å²	104	108.3 Å²	108.3	49%	0.486	51%	0.514	S	S	.	.	H	α-helix	trans	-60.5	-49.6	175.6	-178.8	177.5	-16.4	0	0	111.5	L1128 R1134 L1135 E1136	L1128-Q1132 PolarHBondContact O-N 2.97Å; Q1132-R1134 VanDerWaalsContact C-N 3.34Å; Q1132-R1134 PolarHBondContact O-N 2.89Å; Q1132-L1135 WeakPolarHBondContact O-CA 3.48Å; Q1132-L1135 WeakPolarHBondContact O-CB 3.48Å; Q1132-L1135 PolarHBondContact O-N 2.93Å; Q1132-E1136 PolarHBondContact NE2-OE1 3.41Å; Q1132-E1136 PolarHBondContact O-N 3.06Å
1133	N	90.4	Very high	87.4	Confident	89 Å²	89	110.1 Å²	110.1	48%	0.476	52%	0.515	S	S	.	.	H	α-helix	trans	-56.8	-46.9	176.5	-79.9	-56.3	0	0	0	111.3	L1129 L1135 E1136 D1137	L1129-N1133 WeakPolarHBondContact O-CB 3.42Å; L1129-N1133 PolarHBondContact O-N 3.29Å; L1129-N1133 PolarHBondContact O-ND2 3.33Å; N1133-L1135 VanDerWaalsContact C-N 3.26Å; N1133-L1135 PolarHBondContact O-N 2.88Å; N1133-E1136 PolarHBondContact O-N 3.13Å; N1133-D1137 WeakPolarHBondContact O-CB 3.44Å; N1133-D1137 PolarHBondContact O-N 2.83Å
1134	R	89.6	Confident	87.7	Confident	156 Å²	156	109.5 Å²	109.5	59%	0.589	51%	0.512	S	S	*	.	H	α-helix	trans	-58.3	-35.6	174.6	-80.7	173.1	55.1	-163.6	-6.5	113.3	Q1130 Y1131 Q1132 S1138	Q1130-R1134 WeakPolarHBondContact O-CB 3.49Å; Q1130-R1134 WeakPolarHBondContact O-CG 3.39Å; Q1130-R1134 PolarHBondContact O-N 2.98Å; Y1131-R1134 VanDerWaalsContact CE1-NH1 3.32Å; Y1131-R1134 PolarHBondContact O-N 3.46Å; Q1132-R1134 VanDerWaalsContact C-N 3.34Å; Q1132-R1134 PolarHBondContact O-N 2.89Å; R1134-S1138 WeakPolarHBondContact O-CB 3.32Å; R1134-S1138 PolarHBondContact O-N 3.34Å
1135	L	86.3	Confident	87.9	Confident	125 Å²	125	110.2 Å²	110.2	65%	0.654	51%	0.51	S	S	*	.	H	α-helix	trans	-69.8	-52.6	179.4	-162.4	84.4	0	0	0	110.6	Y1131 Q1132 N1133 D1137 S1138 E1139	Y1131-L1135 WeakPolarHBondContact O-CB 3.49Å; Y1131-L1135 PolarHBondContact O-N 2.91Å; Q1132-L1135 WeakPolarHBondContact O-CA 3.48Å; Q1132-L1135 WeakPolarHBondContact O-CB 3.48Å; Q1132-L1135 PolarHBondContact O-N 2.93Å; N1133-L1135 VanDerWaalsContact C-N 3.26Å; N1133-L1135 PolarHBondContact O-N 2.88Å; L1135-D1137 PolarHBondContact O-N 3.06Å; L1135-S1138 WeakPolarHBondContact O-CA 3.42Å; L1135-S1138 WeakPolarHBondContact O-CB 3.5Å; L1135-S1138 PolarHBondContact O-N 2.94Å; L1135-S1138 VanDerWaalsContact O-N 3.07Å; L1135-S1138 PolarHBondContact O-OG 2.93Å; L1135-E1139 PolarHBondContact O-N 3.1Å
1136	E	88	Confident	88	Confident	66 Å²	66	110.6 Å²	110.6	31%	0.308	51%	0.509	S	S	.	.	H	α-helix	trans	-55.6	-41.8	174.9	-74.7	-170.3	-144.9	0	0	111.9	Q1132 N1133 S1138 E1139 R1140	Q1132-E1136 PolarHBondContact NE2-OE1 3.41Å; Q1132-E1136 PolarHBondContact O-N 3.06Å; N1133-E1136 PolarHBondContact O-N 3.13Å; E1136-S1138 VanDerWaalsContact C-N 3.3Å; E1136-S1138 PolarHBondContact O-N 3.27Å; E1136-E1139 PolarHBondContact O-N 2.76Å; E1136-E1139 VanDerWaalsContact O-N 3.16Å; E1136-R1140 WeakPolarHBondContact O-CB 3.18Å; E1136-R1140 VanDerWaalsContact O-CG 3.23Å; E1136-R1140 WeakPolarHBondContact O-CG 3.41Å; E1136-R1140 PolarHBondContact O-N 3.27Å; E1136-R1140 IonicContact OE2-CZ 2.81Å; E1136-R1140 IonicContact OE2-NE 2.66Å; E1136-R1140 IonicContact OE2-NH2 3.05Å; E1136-R1140 PolarHBondContact OE2-NH2 3.03Å
1137	D	90	Very high	88	Confident	79 Å²	79	108.3 Å²	108.3	42%	0.422	51%	0.507	S	S	.	.	H	α-helix	trans	-66.9	-34	-179.8	-156.7	48.2	0	0	0	111.3	N1133 L1135 R1141	N1133-D1137 WeakPolarHBondContact O-CB 3.44Å; N1133-D1137 PolarHBondContact O-N 2.83Å; L1135-D1137 PolarHBondContact O-N 3.06Å; D1137-R1141 VanDerWaalsContact C-NH2 3.31Å; D1137-R1141 VanDerWaalsContact CG-NH1 3.27Å; D1137-R1141 WeakPolarHBondContact O-CG 3.27Å; D1137-R1141 PolarHBondContact O-N 3.33Å; D1137-R1141 VanDerWaalsContact O-N 3.16Å; D1137-R1141 PolarHBondContact O-NE 2.95Å; D1137-R1141 PolarHBondContact O-NH2 2.78Å; D1137-R1141 IonicContact OD1-NH1 2.93Å; D1137-R1141 IonicContact OD2-CZ 2.73Å; D1137-R1141 VanDerWaalsContact OD2-CZ 3.26Å; D1137-R1141 IonicContact OD2-NH1 3.89Å; D1137-R1141 PolarHBondContact OD2-NH1 3.15Å; D1137-R1141 IonicContact OD2-NH2 3.82Å; D1137-R1141 PolarHBondContact OD2-NH2 2.99Å
1138	S	87.8	Confident	88	Confident	56 Å²	56	109.5 Å²	109.5	39%	0.392	51%	0.511	S	S	.	.	H	α-helix	trans	-69.8	-37.5	170.8	81	0	0	0	0	112.5	R1134 L1135 E1136 R1141 L1142	R1134-S1138 WeakPolarHBondContact O-CB 3.32Å; R1134-S1138 PolarHBondContact O-N 3.34Å; L1135-S1138 WeakPolarHBondContact O-CA 3.42Å; L1135-S1138 WeakPolarHBondContact O-CB 3.5Å; L1135-S1138 PolarHBondContact O-N 2.94Å; L1135-S1138 VanDerWaalsContact O-N 3.07Å; L1135-S1138 PolarHBondContact O-OG 2.93Å; E1136-S1138 VanDerWaalsContact C-N 3.3Å; E1136-S1138 PolarHBondContact O-N 3.27Å; S1138-R1141 PolarHBondContact O-N 2.84Å; S1138-L1142 WeakPolarHBondContact O-CB 3.3Å; S1138-L1142 PolarHBondContact O-N 2.99Å
1139	E	90.4	Very high	88.2	Confident	89 Å²	89	108.6 Å²	108.6	42%	0.416	50%	0.502	S	S	.	.	H	α-helix	trans	-70.4	-41.4	177.2	-152.8	-153.4	150.9	0	0	111.6	L1135 E1136 R1141 L1142 R1143	L1135-E1139 PolarHBondContact O-N 3.1Å; E1136-E1139 PolarHBondContact O-N 2.76Å; E1136-E1139 VanDerWaalsContact O-N 3.16Å; E1139-R1141 VanDerWaalsContact C-N 3.34Å; E1139-R1141 PolarHBondContact O-N 3.24Å; E1139-L1142 PolarHBondContact O-N 3.39Å; E1139-L1142 VanDerWaalsContact O-N 3.1Å; E1139-R1143 WeakPolarHBondContact O-CG 3.48Å; E1139-R1143 PolarHBondContact O-N 3.28Å; E1139-R1143 IonicContact OE1-CZ 3.3Å; E1139-R1143 IonicContact OE1-NE 2.69Å; E1139-R1143 PolarHBondContact OE1-NE 3.25Å; E1139-R1143 IonicContact OE1-NH2 3.7Å; E1139-R1143 PolarHBondContact OE1-NH2 3.04Å; E1139-R1143 IonicContact OE2-NH2 3.12Å
1140	R	90.6	Very high	88.3	Confident	156 Å²	156	106.9 Å²	106.9	59%	0.589	49%	0.494	S	S	*	.	H	α-helix	trans	-57.7	-47.2	173.9	-71.3	166.8	-161.3	-122	6.6	110.3	E1136 L1142 R1143 Q1144	E1136-R1140 WeakPolarHBondContact O-CB 3.18Å; E1136-R1140 VanDerWaalsContact O-CG 3.23Å; E1136-R1140 WeakPolarHBondContact O-CG 3.41Å; E1136-R1140 PolarHBondContact O-N 3.27Å; E1136-R1140 IonicContact OE2-CZ 2.81Å; E1136-R1140 IonicContact OE2-NE 2.66Å; E1136-R1140 IonicContact OE2-NH2 3.05Å; E1136-R1140 PolarHBondContact OE2-NH2 3.03Å; R1140-L1142 VanDerWaalsContact C-N 3.35Å; R1140-L1142 PolarHBondContact O-N 2.99Å; R1140-R1143 PolarHBondContact O-N 3.24Å; R1140-Q1144 WeakPolarHBondContact O-CB 3.42Å; R1140-Q1144 PolarHBondContact O-N 2.59Å
1141	R	88.5	Confident	88.6	Confident	130 Å²	130	105 Å²	105	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-39.4	173	-78.6	-175.4	-74.8	-85.2	-1.5	113.2	D1137 S1138 E1139 Q1144 Q1145	D1137-R1141 VanDerWaalsContact C-NH2 3.31Å; D1137-R1141 VanDerWaalsContact CG-NH1 3.27Å; D1137-R1141 WeakPolarHBondContact O-CG 3.27Å; D1137-R1141 PolarHBondContact O-N 3.33Å; D1137-R1141 VanDerWaalsContact O-N 3.16Å; D1137-R1141 PolarHBondContact O-NE 2.95Å; D1137-R1141 PolarHBondContact O-NH2 2.78Å; D1137-R1141 IonicContact OD1-NH1 2.93Å; D1137-R1141 IonicContact OD2-CZ 2.73Å; D1137-R1141 VanDerWaalsContact OD2-CZ 3.26Å; D1137-R1141 IonicContact OD2-NH1 3.89Å; D1137-R1141 PolarHBondContact OD2-NH1 3.15Å; D1137-R1141 IonicContact OD2-NH2 3.82Å; D1137-R1141 PolarHBondContact OD2-NH2 2.99Å; S1138-R1141 PolarHBondContact O-N 2.84Å; E1139-R1141 VanDerWaalsContact C-N 3.34Å; E1139-R1141 PolarHBondContact O-N 3.24Å; R1141-Q1144 PolarHBondContact O-N 3.36Å; R1141-Q1145 PolarHBondContact O-N 2.91Å
1142	L	88.5	Confident	88.7	Confident	118 Å²	118	104.9 Å²	104.9	62%	0.618	50%	0.498	S	S	*	.	H	α-helix	trans	-68	-43	178.5	-168.6	68.6	0	0	0	111.8	S1138 E1139 R1140 Q1145 Q1146	S1138-L1142 WeakPolarHBondContact O-CB 3.3Å; S1138-L1142 PolarHBondContact O-N 2.99Å; E1139-L1142 PolarHBondContact O-N 3.39Å; E1139-L1142 VanDerWaalsContact O-N 3.1Å; R1140-L1142 VanDerWaalsContact C-N 3.35Å; R1140-L1142 PolarHBondContact O-N 2.99Å; L1142-Q1145 PolarHBondContact O-N 3.16Å; L1142-Q1146 PolarHBondContact O-N 3.46Å
1143	R	88.5	Confident	89	Confident	163 Å²	163	104 Å²	104	62%	0.615	50%	0.496	S	S	*	.	H	α-helix	trans	-62.1	-42.8	173.2	-69.5	-179.1	-175.6	-159	9	111.4	E1139 R1140 Q1146 V1147	E1139-R1143 WeakPolarHBondContact O-CG 3.48Å; E1139-R1143 PolarHBondContact O-N 3.28Å; E1139-R1143 IonicContact OE1-CZ 3.3Å; E1139-R1143 IonicContact OE1-NE 2.69Å; E1139-R1143 PolarHBondContact OE1-NE 3.25Å; E1139-R1143 IonicContact OE1-NH2 3.7Å; E1139-R1143 PolarHBondContact OE1-NH2 3.04Å; E1139-R1143 IonicContact OE2-NH2 3.12Å; R1140-R1143 PolarHBondContact O-N 3.24Å; R1143-Q1146 WeakPolarHBondContact O-CB 3.48Å; R1143-Q1146 PolarHBondContact O-N 2.82Å; R1143-V1147 WeakPolarHBondContact O-CG2 3.13Å; R1143-V1147 PolarHBondContact O-N 3.46Å
1144	Q	89.3	Confident	88.9	Confident	117 Å²	117	106.5 Å²	106.5	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-57.1	-52.1	174.9	-167.6	75.1	19.4	0	0	111.3	R1140 R1141 Q1146 V1147 E1148	R1140-Q1144 WeakPolarHBondContact O-CB 3.42Å; R1140-Q1144 PolarHBondContact O-N 2.59Å; R1141-Q1144 PolarHBondContact O-N 3.36Å; Q1144-Q1146 VanDerWaalsContact C-N 3.26Å; Q1144-Q1146 PolarHBondContact O-N 3.34Å; Q1144-V1147 PolarHBondContact O-N 3.31Å; Q1144-E1148 WeakPolarHBondContact O-CG 3.46Å; Q1144-E1148 PolarHBondContact O-N 3.11Å
1145	Q	87.6	Confident	88.9	Confident	94 Å²	94	100.2 Å²	100.2	44%	0.439	49%	0.485	S	S	.	.	H	α-helix	trans	-61.8	-31.5	176.6	-76	-165.9	18.5	0	0	113.5	R1141 L1142 K1149	R1141-Q1145 PolarHBondContact O-N 2.91Å; L1142-Q1145 PolarHBondContact O-N 3.16Å; Q1145-K1149 WeakPolarHBondContact O-CB 3.45Å; Q1145-K1149 VanDerWaalsContact O-CD 3.3Å; Q1145-K1149 WeakPolarHBondContact O-CD 3.44Å; Q1145-K1149 WeakPolarHBondContact O-CG 3.25Å; Q1145-K1149 PolarHBondContact O-N 2.9Å
1146	Q	86.4	Confident	89.1	Confident	93 Å²	93	98.1 Å²	98.1	44%	0.435	47%	0.474	S	S	.	.	H	α-helix	trans	-68.4	-45.5	176	-176.9	55.4	42.1	0	0	110.7	L1142 R1143 Q1144 E1148 K1149 D1150	L1142-Q1146 PolarHBondContact O-N 3.46Å; R1143-Q1146 WeakPolarHBondContact O-CB 3.48Å; R1143-Q1146 PolarHBondContact O-N 2.82Å; Q1144-Q1146 VanDerWaalsContact C-N 3.26Å; Q1144-Q1146 PolarHBondContact O-N 3.34Å; Q1146-E1148 PolarHBondContact O-N 3.25Å; Q1146-K1149 PolarHBondContact O-N 2.89Å; Q1146-D1150 PolarHBondContact NE2-OD1 3.29Å; Q1146-D1150 PolarHBondContact NE2-OD2 2.95Å; Q1146-D1150 WeakPolarHBondContact O-CB 3.32Å; Q1146-D1150 PolarHBondContact O-N 3.16Å
1147	V	90.9	Very high	89.1	Confident	97 Å²	97	98.9 Å²	98.9	59%	0.588	48%	0.48	S	S	*	.	H	α-helix	trans	-61.7	-41.4	175.2	173.2	0	0	0	0	111.7	R1143 Q1144 D1150 S1151	R1143-V1147 WeakPolarHBondContact O-CG2 3.13Å; R1143-V1147 PolarHBondContact O-N 3.46Å; Q1144-V1147 PolarHBondContact O-N 3.31Å; V1147-D1150 PolarHBondContact O-N 2.83Å; V1147-S1151 WeakPolarHBondContact O-CB 3.45Å; V1147-S1151 PolarHBondContact O-N 2.96Å
1148	E	90.1	Very high	89	Confident	101 Å²	101	99.8 Å²	99.8	47%	0.472	48%	0.484	S	S	.	.	H	α-helix	trans	-63.2	-44.3	175.5	-73.9	168.7	-169.2	0	0	112.3	Q1144 Q1146 S1151 Q1152	Q1144-E1148 WeakPolarHBondContact O-CG 3.46Å; Q1144-E1148 PolarHBondContact O-N 3.11Å; Q1146-E1148 PolarHBondContact O-N 3.25Å; E1148-S1151 WeakPolarHBondContact O-CB 3.36Å; E1148-S1151 PolarHBondContact O-N 3.07Å; E1148-Q1152 WeakPolarHBondContact O-CG 3.28Å; E1148-Q1152 PolarHBondContact O-N 3.03Å
1149	K	88.5	Confident	88.9	Confident	94 Å²	94	104.8 Å²	104.8	41%	0.409	50%	0.495	S	S	.	.	H	α-helix	trans	-65.5	-41.4	176.3	-73.2	162.7	-166.4	157.4	0	111.7	Q1145 Q1146 S1151 Q1152 I1153	Q1145-K1149 WeakPolarHBondContact O-CB 3.45Å; Q1145-K1149 VanDerWaalsContact O-CD 3.3Å; Q1145-K1149 WeakPolarHBondContact O-CD 3.44Å; Q1145-K1149 WeakPolarHBondContact O-CG 3.25Å; Q1145-K1149 PolarHBondContact O-N 2.9Å; Q1146-K1149 PolarHBondContact O-N 2.89Å; K1149-S1151 VanDerWaalsContact C-N 3.3Å; K1149-S1151 PolarHBondContact O-N 3.45Å; K1149-Q1152 PolarHBondContact O-N 3.04Å; K1149-I1153 WeakPolarHBondContact O-CB 3.45Å; K1149-I1153 VanDerWaalsContact O-CG1 3.25Å; K1149-I1153 WeakPolarHBondContact O-CG1 3.21Å; K1149-I1153 PolarHBondContact O-N 2.85Å
1150	D	89.1	Confident	88.7	Confident	64 Å²	64	105.8 Å²	105.8	34%	0.342	50%	0.502	S	S	.	.	H	α-helix	trans	-68.1	-30.8	176	-69.5	-28.1	0	0	0	112.1	Q1146 V1147 K1154	Q1146-D1150 PolarHBondContact NE2-OD1 3.29Å; Q1146-D1150 PolarHBondContact NE2-OD2 2.95Å; Q1146-D1150 WeakPolarHBondContact O-CB 3.32Å; Q1146-D1150 PolarHBondContact O-N 3.16Å; V1147-D1150 PolarHBondContact O-N 2.83Å; D1150-K1154 VanDerWaalsContact O-CG 3.27Å; D1150-K1154 WeakPolarHBondContact O-CG 3.37Å; D1150-K1154 PolarHBondContact O-N 2.88Å
1151	S	91.4	Very high	88.2	Confident	76 Å²	76	102.9 Å²	102.9	53%	0.531	50%	0.496	S	S	.	.	H	α-helix	trans	-67.2	-45.2	170	-169.3	0	0	0	0	111.9	V1147 E1148 K1149 I1153 K1154 G1155	V1147-S1151 WeakPolarHBondContact O-CB 3.45Å; V1147-S1151 PolarHBondContact O-N 2.96Å; E1148-S1151 WeakPolarHBondContact O-CB 3.36Å; E1148-S1151 PolarHBondContact O-N 3.07Å; K1149-S1151 VanDerWaalsContact C-N 3.3Å; K1149-S1151 PolarHBondContact O-N 3.45Å; S1151-I1153 VanDerWaalsContact C-N 3.34Å; S1151-I1153 PolarHBondContact O-N 3.12Å; S1151-K1154 PolarHBondContact O-N 3.28Å; S1151-G1155 PolarHBondContact O-N 3.44Å
1152	Q	86.2	Confident	87.8	Confident	135 Å²	135	99.4 Å²	99.4	63%	0.631	50%	0.495	S	S	*	.	H	α-helix	trans	-60.5	-41.8	173.1	-73	-178.1	-2	0	0	112.1	E1148 K1149 G1155 I1156	E1148-Q1152 WeakPolarHBondContact O-CG 3.28Å; E1148-Q1152 PolarHBondContact O-N 3.03Å; K1149-Q1152 PolarHBondContact O-N 3.04Å; Q1152-G1155 PolarHBondContact O-N 2.82Å; Q1152-I1156 VanDerWaalsContact O-CG1 3.31Å; Q1152-I1156 WeakPolarHBondContact O-CG1 3.36Å; Q1152-I1156 PolarHBondContact O-N 2.87Å
1153	I	90.4	Very high	87.3	Confident	87 Å²	87	97 Å²	97	45%	0.446	49%	0.485	S	S	.	.	H	α-helix	trans	-62.4	-45.8	175.9	-71.2	163.6	0	0	0	110.7	K1149 S1151 G1155 I1156 I1157	K1149-I1153 WeakPolarHBondContact O-CB 3.45Å; K1149-I1153 VanDerWaalsContact O-CG1 3.25Å; K1149-I1153 WeakPolarHBondContact O-CG1 3.21Å; K1149-I1153 PolarHBondContact O-N 2.85Å; S1151-I1153 VanDerWaalsContact C-N 3.34Å; S1151-I1153 PolarHBondContact O-N 3.12Å; I1153-G1155 VanDerWaalsContact C-N 3.33Å; I1153-G1155 PolarHBondContact O-N 3.14Å; I1153-I1156 PolarHBondContact O-N 3.06Å; I1153-I1157 HydrophobicContact CG2-CD1 3.8Å; I1153-I1157 HydrophobicContact CG2-CG1 4.48Å; I1153-I1157 VanDerWaalsContact O-CG1 3.31Å; I1153-I1157 WeakPolarHBondContact O-CG1 3.39Å; I1153-I1157 PolarHBondContact O-N 2.68Å
1154	K	89.4	Confident	86.8	Confident	141 Å²	141	92.6 Å²	92.6	61%	0.613	47%	0.472	S	S	*	.	H	α-helix	trans	-58.5	-43.2	172.8	-73.7	167.2	-177.7	176.8	0	111.9	D1150 S1151 I1156 I1157 N1158	D1150-K1154 VanDerWaalsContact O-CG 3.27Å; D1150-K1154 WeakPolarHBondContact O-CG 3.37Å; D1150-K1154 PolarHBondContact O-N 2.88Å; S1151-K1154 PolarHBondContact O-N 3.28Å; K1154-I1156 VanDerWaalsContact C-N 3.34Å; K1154-I1156 PolarHBondContact O-N 2.94Å; K1154-I1157 PolarHBondContact O-N 3.45Å; K1154-N1158 VanDerWaalsContact O-CG 3.29Å; K1154-N1158 PolarHBondContact O-N 3.36Å; K1154-N1158 PolarHBondContact O-OD1 2.99Å
1155	G	89.8	Confident	86.1	Confident	23 Å²	23	91.4 Å²	91.4	24%	0.237	47%	0.469	C	S	.	.	H	α-helix	trans	-63.5	-35.2	175.7	0	0	0	0	0	113.8	S1151 Q1152 I1153 R1159	S1151-G1155 PolarHBondContact O-N 3.44Å; Q1152-G1155 PolarHBondContact O-N 2.82Å; I1153-G1155 VanDerWaalsContact C-N 3.33Å; I1153-G1155 PolarHBondContact O-N 3.14Å; G1155-R1159 WeakPolarHBondContact O-CG 3.44Å; G1155-R1159 PolarHBondContact O-N 3.34Å; G1155-R1159 PolarHBondContact O-NH1 3.03Å
1156	I	89.8	Confident	85.3	Confident	82 Å²	82	94 Å²	94	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-68.8	-46.2	172.7	-69.1	162.1	0	0	0	110.5	Q1152 I1153 K1154 N1158 R1159 L1160	Q1152-I1156 VanDerWaalsContact O-CG1 3.31Å; Q1152-I1156 WeakPolarHBondContact O-CG1 3.36Å; Q1152-I1156 PolarHBondContact O-N 2.87Å; I1153-I1156 PolarHBondContact O-N 3.06Å; K1154-I1156 VanDerWaalsContact C-N 3.34Å; K1154-I1156 PolarHBondContact O-N 2.94Å; I1156-N1158 PolarHBondContact O-N 3.24Å; I1156-R1159 PolarHBondContact O-N 3.41Å; I1156-L1160 HydrophobicContact CG2-CD1 3.83Å; I1156-L1160 HydrophobicContact CG2-CG 4.35Å; I1156-L1160 WeakPolarHBondContact O-CG 3.46Å; I1156-L1160 PolarHBondContact O-N 2.91Å
1157	I	87.3	Confident	84.4	Confident	82 Å²	82	95.9 Å²	95.9	42%	0.421	49%	0.493	S	S	.	.	H	α-helix	trans	-58.7	-46.2	177.4	-69.1	164.8	0	0	0	110.6	I1153 K1154 R1159 L1160 M1161	I1153-I1157 HydrophobicContact CG2-CD1 3.8Å; I1153-I1157 HydrophobicContact CG2-CG1 4.48Å; I1153-I1157 VanDerWaalsContact O-CG1 3.31Å; I1153-I1157 WeakPolarHBondContact O-CG1 3.39Å; I1153-I1157 PolarHBondContact O-N 2.68Å; K1154-I1157 PolarHBondContact O-N 3.45Å; I1157-R1159 VanDerWaalsContact C-N 3.34Å; I1157-R1159 PolarHBondContact O-N 3.15Å; I1157-L1160 CarbonylContact O-C 3.57Å; I1157-L1160 PolarHBondContact O-N 2.71Å; I1157-L1160 VanDerWaalsContact O-N 3.13Å; I1157-M1161 HydrophobicContact CG2-CE 4.27Å; I1157-M1161 HydrophobicContact CG2-CG 4.39Å; I1157-M1161 HydrophobicContact CG2-SD 4.35Å; I1157-M1161 WeakPolarHBondContact O-CG 3.44Å; I1157-M1161 PolarHBondContact O-N 2.78Å
1158	N	87.4	Confident	83.3	Confident	97 Å²	97	97.7 Å²	97.7	52%	0.519	49%	0.49	S	S	.	.	H	α-helix	trans	-61.1	-40.4	179	-70.8	0.3	0	0	0	112.5	K1154 I1156 M1161 A1162	K1154-N1158 VanDerWaalsContact O-CG 3.29Å; K1154-N1158 PolarHBondContact O-N 3.36Å; K1154-N1158 PolarHBondContact O-OD1 2.99Å; I1156-N1158 PolarHBondContact O-N 3.24Å; N1158-M1161 PolarHBondContact O-N 2.86Å; N1158-M1161 WeakPolarHBondContact OD1-CE 3.49Å; N1158-A1162 PolarHBondContact O-N 3.4Å; N1158-A1162 VanDerWaalsContact O-N 3.08Å
1159	R	87.8	Confident	81.7	Confident	161 Å²	161	96.2 Å²	96.2	61%	0.608	50%	0.501	S	S	*	.	H	α-helix	trans	-67.3	-38.2	173.6	-71.9	-171.5	-62.9	-91.6	3	112.5	G1155 I1156 I1157 A1162 V1163	G1155-R1159 WeakPolarHBondContact O-CG 3.44Å; G1155-R1159 PolarHBondContact O-N 3.34Å; G1155-R1159 PolarHBondContact O-NH1 3.03Å; I1156-R1159 PolarHBondContact O-N 3.41Å; I1157-R1159 VanDerWaalsContact C-N 3.34Å; I1157-R1159 PolarHBondContact O-N 3.15Å; R1159-A1162 PolarHBondContact O-N 3.14Å; R1159-V1163 WeakPolarHBondContact O-CG2 3.44Å; R1159-V1163 PolarHBondContact O-N 3.39Å
1160	L	85.5	Confident	79.4	Confident	111 Å²	111	94.9 Å²	94.9	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-68.2	-32.8	176	-71.3	172.5	0	0	0	112.6	I1156 I1157 E1164	I1156-L1160 HydrophobicContact CG2-CD1 3.83Å; I1156-L1160 HydrophobicContact CG2-CG 4.35Å; I1156-L1160 WeakPolarHBondContact O-CG 3.46Å; I1156-L1160 PolarHBondContact O-N 2.91Å; I1157-L1160 CarbonylContact O-C 3.57Å; I1157-L1160 PolarHBondContact O-N 2.71Å; I1157-L1160 VanDerWaalsContact O-N 3.13Å; L1160-E1164 WeakPolarHBondContact O-CB 3.45Å; L1160-E1164 PolarHBondContact O-N 3.48Å
1161	M	80.3	Confident	77	Confident	94 Å²	94	96.1 Å²	96.1	46%	0.463	53%	0.533	S	S	.	.	H	α-helix	trans	-67.8	-46	172	-69	-169.6	-56.9	0	0	111.3	I1157 N1158 V1163 E1164 D1165	I1157-M1161 HydrophobicContact CG2-CE 4.27Å; I1157-M1161 HydrophobicContact CG2-CG 4.39Å; I1157-M1161 HydrophobicContact CG2-SD 4.35Å; I1157-M1161 WeakPolarHBondContact O-CG 3.44Å; I1157-M1161 PolarHBondContact O-N 2.78Å; N1158-M1161 PolarHBondContact O-N 2.86Å; N1158-M1161 WeakPolarHBondContact OD1-CE 3.49Å; M1161-V1163 VanDerWaalsContact C-N 3.3Å; M1161-V1163 PolarHBondContact O-N 3.05Å; M1161-E1164 PolarHBondContact O-N 3.41Å; M1161-D1165 PolarHBondContact O-N 2.66Å
1162	A	78.7	Confident	74.5	Confident	57 Å²	57	99.3 Å²	99.3	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-56.8	-43.6	175.5	0	0	0	0	0	112.1	N1158 R1159 D1165 E1166	N1158-A1162 PolarHBondContact O-N 3.4Å; N1158-A1162 VanDerWaalsContact O-N 3.08Å; R1159-A1162 PolarHBondContact O-N 3.14Å; A1162-D1165 PolarHBondContact O-N 2.7Å; A1162-E1166 PolarHBondContact O-N 3.35Å
1163	V	78.3	Confident	72.1	Confident	67 Å²	67	103.4 Å²	103.4	41%	0.406	55%	0.554	S	S	.	*	H	α-helix	trans	-69	-34.9	174.5	172.7	0	0	0	0	112.3	R1159 M1161 D1165 I1167	R1159-V1163 WeakPolarHBondContact O-CG2 3.44Å; R1159-V1163 PolarHBondContact O-N 3.39Å; M1161-V1163 VanDerWaalsContact C-N 3.3Å; M1161-V1163 PolarHBondContact O-N 3.05Å; V1163-D1165 VanDerWaalsContact C-N 3.27Å; V1163-D1165 PolarHBondContact O-N 3.47Å; V1163-I1167 HydrophobicContact CG1-CD1 3.79Å; V1163-I1167 HydrophobicContact CG1-CG1 4.47Å; V1163-I1167 WeakPolarHBondContact O-CB 3.43Å; V1163-I1167 WeakPolarHBondContact O-CD1 3.24Å; V1163-I1167 WeakPolarHBondContact O-CG1 3.42Å; V1163-I1167 PolarHBondContact O-N 2.86Å
1164	E	78	Confident	69.5	Low	71 Å²	71	107.1 Å²	107.1	33%	0.332	57%	0.57	S	S	.	*	H	α-helix	trans	-66.3	-30.6	173.4	-154.2	-166.4	153.9	0	0	111.8	R28 L1160 M1161 R1168	R28-E1164 IonicContact CZ-OE1 3.67Å; R28-E1164 IonicContact CZ-OE2 3.73Å; R28-E1164 IonicContact NE-OE1 2.9Å; R28-E1164 IonicContact NH1-OE1 2.73Å; R28-E1164 PolarHBondContact NH1-OE1 3.48Å; R28-E1164 IonicContact NH1-OE2 3.16Å; R28-E1164 PolarHBondContact NH1-OE2 3.42Å; R28-E1164 IonicContact NH2-OE1 2.69Å; L1160-E1164 WeakPolarHBondContact O-CB 3.45Å; L1160-E1164 PolarHBondContact O-N 3.48Å; M1161-E1164 PolarHBondContact O-N 3.41Å; E1164-R1168 WeakPolarHBondContact O-CB 3.3Å; E1164-R1168 PolarHBondContact O-N 3.4Å; E1164-R1168 IonicContact OE1-CZ 2.68Å; E1164-R1168 IonicContact OE1-NH2 2.72Å; E1164-R1168 PolarHBondContact OE1-NH2 3.39Å; E1164-R1168 IonicContact OE2-NH2 3.87Å
1165	D	75	Confident	67.6	Low	92 Å²	92	105.1 Å²	105.1	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-82.3	-33.6	177.4	-70.1	-28.6	0	0	0	112.8	M1161 A1162 V1163 R1168 G1169	M1161-D1165 PolarHBondContact O-N 2.66Å; A1162-D1165 PolarHBondContact O-N 2.7Å; V1163-D1165 VanDerWaalsContact C-N 3.27Å; V1163-D1165 PolarHBondContact O-N 3.47Å; D1165-R1168 CarbonylContact O-C 3.58Å; D1165-R1168 WeakPolarHBondContact O-CB 3.28Å; D1165-R1168 PolarHBondContact O-N 2.97Å; D1165-R1168 IonicContact OD1-NE 3.88Å; D1165-R1168 PolarHBondContact OD1-NE 2.67Å; D1165-R1168 IonicContact OD1-NH2 3.62Å; D1165-G1169 PolarHBondContact O-N 2.93Å
1166	E	70.4	Confident	64.6	Low	149 Å²	149	113.1 Å²	113.1	70%	0.696	60%	0.599	S	S	*	*	H	α-helix	trans	-58.7	-46.3	164.6	-75.8	-175	134.3	0	0	111.3	A1162 R1168 G1169	A1162-E1166 PolarHBondContact O-N 3.35Å; E1166-R1168 PolarHBondContact O-N 3.09Å; E1166-G1169 WeakPolarHBondContact O-CA 3.17Å; E1166-G1169 PolarHBondContact O-N 3.29Å
1167	I	68.4	Low	61.7	Low	133 Å²	133	114.5 Å²	114.5	68%	0.682	61%	0.612	S	S	*	*	H	α-helix	trans	-66.5	-24.6	177.3	-69	168	0	0	0	111.9	V1163 G1169	V1163-I1167 HydrophobicContact CG1-CD1 3.79Å; V1163-I1167 HydrophobicContact CG1-CG1 4.47Å; V1163-I1167 WeakPolarHBondContact O-CB 3.43Å; V1163-I1167 WeakPolarHBondContact O-CD1 3.24Å; V1163-I1167 WeakPolarHBondContact O-CG1 3.42Å; V1163-I1167 PolarHBondContact O-N 2.86Å; I1167-G1169 VanDerWaalsContact C-N 3.34Å
1168	R	67.4	Low	59	Low	135 Å²	135	121.7 Å²	121.7	51%	0.509	63%	0.633	S	S	.	*	H	α-helix	trans	-81.3	-13.9	171.2	-158.9	-176.8	-49.2	-67.8	-10.1	112.7	E1164 D1165 E1166 G1170	E1164-R1168 WeakPolarHBondContact O-CB 3.3Å; E1164-R1168 PolarHBondContact O-N 3.4Å; E1164-R1168 IonicContact OE1-CZ 2.68Å; E1164-R1168 IonicContact OE1-NH2 2.72Å; E1164-R1168 PolarHBondContact OE1-NH2 3.39Å; E1164-R1168 IonicContact OE2-NH2 3.87Å; D1165-R1168 CarbonylContact O-C 3.58Å; D1165-R1168 WeakPolarHBondContact O-CB 3.28Å; D1165-R1168 PolarHBondContact O-N 2.97Å; D1165-R1168 IonicContact OD1-NE 3.88Å; D1165-R1168 PolarHBondContact OD1-NE 2.67Å; D1165-R1168 IonicContact OD1-NH2 3.62Å; E1166-R1168 PolarHBondContact O-N 3.09Å; R1168-G1170 PolarHBondContact O-N 2.69Å
1169	G	55.7	Low	56.2	Low	69 Å²	69	125.2 Å²	125.2	71%	0.711	65%	0.651	S	S	*	*	S	Bend	trans	-71.2	-18.8	-170.7	0	0	0	0	0	116.1	D1165 E1166 I1167	D1165-G1169 PolarHBondContact O-N 2.93Å; E1166-G1169 WeakPolarHBondContact O-CA 3.17Å; E1166-G1169 PolarHBondContact O-N 3.29Å; I1167-G1169 VanDerWaalsContact C-N 3.34Å
1170	G	41.2	Very low	53.5	Low	66 Å²	66	127.1 Å²	127.1	68%	0.68	66%	0.663	S	S	*	*			trans	136.7	-179	164.5	0	0	0	0	0	116.1	R1168	R1168-G1170 PolarHBondContact O-N 2.69Å
1171	A	38.2	Very low	50.9	Low	90 Å²	90	126.3 Å²	126.3	74%	0.744	67%	0.673	S	S	*	*			trans	-137.8	120.2	-177.2	0	0	0	0	0	111.6
1172	I	40.5	Very low	48.4	Very low	143 Å²	143	127.8 Å²	127.8	73%	0.733	68%	0.683	S	S	*	*			trans	57.8	108.8	148.4	-40.3	165.4	0	0	0	117.4
1173	Y	35.2	Very low	46.2	Very low	221 Å²	221	133.6 Å²	133.6	87%	0.867	70%	0.7	S	S	*	*				-171.1	149	104.8	-111.5	-75.5	0	0	0	115
1174	E	35.4	Very low	43.7	Very low	166 Å²	166	133.6 Å²	133.6	78%	0.776	71%	0.714	S	S	*	*			trans	-74.3	-174.1	168	-103.4	-169	129.4	0	0	113.2
1175	P	48.9	Very low	41.5	Very low	98 Å²	98	140.4 Å²	140.4	64%	0.636	74%	0.737	S	S	*	*			cis	-135	172.4	-15.7	30.5	-11	0	0	0	114.9
1176	K	27.2	Very low	39.2	Very low	191 Å²	191	144.9 Å²	144.9	83%	0.83	75%	0.747	S	S	*	*				174.4	110.8	124.9	-98.5	171.4	-178.9	176.4	0	117
1177	T	29	Very low	37.1	Very low	112 Å²	112	145.2 Å²	145.2	69%	0.687	75%	0.748	S	S	*	*			trans	41	120.6	131.7	57.1	0	0	0	0	123.9
1178	R	30.3	Very low	35.1	Very low	232 Å²	232	143.4 Å²	143.4	88%	0.875	75%	0.748	S	S	*	*			trans	69.4	127.7	131.9	-64.9	178.9	178.6	178.5	-0.5	120.9
1179	I	28.5	Very low	33.1	Very low	172 Å²	172	143.5 Å²	143.5	88%	0.882	76%	0.756	S	S	*	*				-154.9	162.4	103.2	-98.3	158.4	0	0	0	109.2
1180	F	32.2	Very low	31.8	Very low	200 Å²	200	147.2 Å²	147.2	88%	0.877	76%	0.759	S	S	*	*			trans	-110.4	136.9	-171.6	-115.7	-96.6	0	0	0	112.5
1181	A	30.1	Very low	31.1	Very low	95 Å²	95	149.9 Å²	149.9	79%	0.785	76%	0.762	S	S	*	*			trans	-166.5	115.6	149.3	0	0	0	0	0	105.5
1182	D	28.4	Very low	30.6	Very low	125 Å²	125	154.2 Å²	154.2	67%	0.668	77%	0.767	S	S	*	*			cis	84.3	136	44.7	-167.1	41.5	0	0	0	114.3
1183	Q	31.2	Very low	30.9	Very low	178 Å²	178	152.2 Å²	152.2	83%	0.832	76%	0.763	S	S	*	*			trans	60.9	147.2	-178.4	-66.4	159	67.5	0	0	116.9
1184	G	27.2	Very low	30.7	Very low	68 Å²	68	153.6 Å²	153.6	70%	0.701	77%	0.767	S	S	*	*			cis	171.7	140.5	-10.1	0	0	0	0	0	114.5
1185	R	30.5	Very low	30.4	Very low	214 Å²	214	153.5 Å²	153.5	81%	0.808	77%	0.771	S	S	*	*			trans	43.3	117.5	155.1	-69.1	-174.9	174	-163.5	1.1	121.6
1186	R	27.1	Very low	29.5	Very low	186 Å²	186	152.8 Å²	152.8	70%	0.702	77%	0.773	S	S	*	*				68.4	147.9	122.4	-65.5	-177.8	171.9	-172.1	-3.8	121.9
1187	Q	26.5	Very low	30	Very low	156 Å²	156	150 Å²	150	73%	0.729	77%	0.774	S	S	*	*			trans	69.5	147.1	150.1	-74.9	156.8	-51	0	0	115.8
1188	S	26.8	Very low	30	Very low	95 Å²	95	150.5 Å²	150.5	66%	0.664	78%	0.777	S	S	*	*			cis	-142	147.9	4.1	-99.8	0	0	0	0	108.9
1189	I	25.6	Very low	31.4	Very low	136 Å²	136	144.1 Å²	144.1	70%	0.697	77%	0.766	S	S	*	*				71.4	136.1	67.8	-61.9	170.6	0	0	0	113.8
1190	L	28.1	Very low	32.2	Very low	147 Å²	147	141.7 Å²	141.7	77%	0.77	76%	0.761	S	S	*	*			trans	71.6	134.6	176.6	-104.4	53.7	0	0	0	116.1
1191	V	26.2	Very low	32	Very low	123 Å²	123	142.7 Å²	142.7	75%	0.745	76%	0.759	S	S	*	*			cis	80.1	139.3	20.7	-173.1	0	0	0	0	114.9
1192	Q	26.6	Very low	32.3	Very low	181 Å²	181	144.4 Å²	144.4	85%	0.846	76%	0.76	S	S	*	*			trans	81.8	156.1	169.2	-94.4	-166	33.5	0	0	117.7
1193	P	48.5	Very low	32.9	Very low	100 Å²	100	143.7 Å²	143.7	65%	0.649	76%	0.762	S	S	*	*				-138.5	-167.8	-118.3	43.7	-25.1	0	0	0	114.4
1194	R	29.8	Very low	32.7	Very low	251 Å²	251	139.8 Å²	139.8	95%	0.947	76%	0.755	S	S	*	*			trans	-154.9	162.8	139	-114.5	162.3	-171.1	-151.2	-1.2	114.2
1195	L	29.4	Very low	32.8	Very low	163 Å²	163	145 Å²	145	85%	0.853	76%	0.76	S	S	*	*			trans	-115.3	176	-168.9	-79.5	158.2	0	0	0	111.7
1196	A	30.3	Very low	32.5	Very low	83 Å²	83	139.6 Å²	139.6	69%	0.686	76%	0.755	S	S	*	*			trans	76	163.5	163.5	0	0	0	0	0	114.8	V1198	A1196-V1198 HydrophobicContact CB-CG2 4.45Å
1197	P	36.8	Very low	32.6	Very low	132 Å²	132	139.4 Å²	139.4	86%	0.857	76%	0.762	S	S	*	*			cis	-97.4	178.8	39	-10.6	31.3	0	0	0	118.7
1198	V	30.8	Very low	32.5	Very low	124 Å²	124	136.4 Å²	136.4	75%	0.752	76%	0.758	S	S	*	*			trans	-150.4	-166.6	175.2	-159.4	0	0	0	0	107.3	A1196	A1196-V1198 HydrophobicContact CB-CG2 4.45Å
1199	P	60	Low	32.5	Very low	98 Å²	98	139.8 Å²	139.8	64%	0.636	76%	0.762	S	S	*	*				-60.1	-130	-99.1	42.8	-39.7	0	0	0	113.7
1200	P	44.5	Very low	32.6	Very low	121 Å²	121	140 Å²	140	79%	0.786	76%	0.761	S	S	*	*			cis	-69.4	-176.8	-6.6	-18.9	35.4	0	0	0	115.3
1201	R	26.9	Very low	32.7	Very low	220 Å²	220	140.1 Å²	140.1	83%	0.83	76%	0.758	S	S	*	*			cis	94.8	101.8	2.4	-74.4	-173.3	169.6	174.8	-3.3	121.9
1202	V	37.5	Very low	32.9	Very low	132 Å²	132	140.5 Å²	140.5	80%	0.8	76%	0.756	S	S	*	*				9.5	155.8	129.3	-84.5	0	0	0	0	121
1203	P	40.1	Very low	33.1	Very low	109 Å²	109	137.7 Å²	137.7	71%	0.708	75%	0.747	S	S	*	*			cis	-150.7	-177	35.5	40.6	-17.7	0	0	0	120.8
1204	S	28.2	Very low	32.1	Very low	97 Å²	97	138.9 Å²	138.9	68%	0.678	75%	0.751	S	S	*	*			trans	75.5	120.9	136.7	63.1	0	0	0	0	126.3
1205	H	27.7	Very low	32.2	Very low	176 Å²	176	133.6 Å²	133.6	82%	0.815	74%	0.737	S	S	*	*				79.1	109.5	126.7	-78.7	-49.3	0	0	0	125.8
1206	S	26.2	Very low	33.1	Very low	101 Å²	101	130.3 Å²	130.3	71%	0.706	73%	0.726	S	S	*	*				96.9	158.2	111.5	77.1	0	0	0	0	122.2
1207	Q	27.5	Very low	33.3	Very low	183 Å²	183	131.3 Å²	131.3	86%	0.855	72%	0.72	S	S	*	*			trans	71.9	158.4	176.4	-62.4	-173.8	-9.4	0	0	118
1208	S	25.6	Very low	33	Very low	92 Å²	92	134.4 Å²	134.4	64%	0.643	72%	0.715	S	S	*	*				-177.4	173	-69.9	49.7	0	0	0	0	112.2
1209	F	26.7	Very low	32.9	Very low	167 Å²	167	134.9 Å²	134.9	73%	0.732	71%	0.712	S	S	*	*			trans	83.5	118.2	164.2	-88.9	-111.1	0	0	0	120.8
1210	M	27.4	Very low	31.4	Very low	139 Å²	139	136.7 Å²	136.7	69%	0.685	71%	0.714	S	S	*	*				59.3	146.5	124.1	-72.3	-172.1	170.5	0	0	122.8
1211	E	30.6	Very low	30.7	Very low	151 Å²	151	137.7 Å²	137.7	71%	0.706	71%	0.708	S	S	*	*			cis	-166.6	-169.7	-19.6	-155.4	144.1	-138.3	0	0	110.3
1212	D	29.6	Very low	30.8	Very low	130 Å²	130	134 Å²	134	70%	0.695	70%	0.699	S	S	*	*			trans	76	130.1	166	-86.5	26.2	0	0	0	120.2
1213	N	30.8	Very low	30.2	Very low	123 Å²	123	136.1 Å²	136.1	66%	0.658	69%	0.693	S	S	*	*			cis	-160.5	160.2	-9.1	-144.3	-40.5	0	0	0	112.9
1214	V	28.5	Very low	29.5	Very low	124 Å²	124	138.2 Å²	138.2	75%	0.752	69%	0.693	S	S	*	*			trans	70.6	155.8	171.1	176.4	0	0	0	0	117.2
1215	E	30.6	Very low	29.3	Very low	140 Å²	140	138 Å²	138	65%	0.654	69%	0.692	S	S	*	*			cis	148.9	160.7	-41.3	-89.9	-73.6	71.2	0	0	111.2
1216	P	49.3	Very low	29.1	Very low	95 Å²	95	135.1 Å²	135.1	62%	0.617	69%	0.692	S	S	*	*			cis	-139.7	148.1	-20	36.1	-17.1	0	0	0	118.5
1217	N	33.6	Very low	29.1	Very low	103 Å²	103	133.6 Å²	133.6	55%	0.551	69%	0.692	S	S	*	*			trans	66.9	156.1	132.7	-72	-40.8	0	0	0	124.7
1218	W	30.5	Very low	28.8	Very low	197 Å²	197	136 Å²	136	75%	0.746	69%	0.693	S	S	*	*			cis	-153.4	168.2	3	-118.5	127.7	0	0	0	113.2
1219	L	28.1	Very low	28.8	Very low	134 Å²	134	140 Å²	140	70%	0.702	70%	0.702	S	S	*	*			trans	83.5	128.4	160.1	-69.6	156.7	0	0	0	117.6
1220	M	29.5	Very low	28.8	Very low	137 Å²	137	135.3 Å²	135.3	68%	0.675	70%	0.7	S	S	*	*			cis	69.9	136	19.8	-68.5	-75.7	-172.5	0	0	115.6
1221	H	29.5	Very low	28.7	Very low	142 Å²	142	136.8 Å²	136.8	66%	0.657	71%	0.705	S	S	*	*			cis	-150	150.6	49.8	-94	-93.2	0	0	0	112.4
1222	H	28.3	Very low	28.6	Very low	141 Å²	141	135.9 Å²	135.9	65%	0.653	70%	0.703	S	S	*	*				57.8	149.3	88.5	-91.5	-35.3	0	0	0	115.4
1223	R	26.4	Very low	28.5	Very low	178 Å²	178	134.6 Å²	134.6	67%	0.672	70%	0.704	S	S	*	*			cis	-172.7	153.1	12.4	-138.9	175.2	-168.5	-135.4	19.9	111.7
1224	Q	25.6	Very low	28.4	Very low	152 Å²	152	139.4 Å²	139.4	71%	0.71	71%	0.713	S	S	*	*			trans	55.9	176.9	144.6	-80.4	166.9	-19.3	0	0	119.5
1225	S	23.8	Very low	28.3	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	71%	0.708	S	S	*	*			cis	-170.7	155.3	-32.3	173.7	0	0	0	0	111.7
1226	S	23.9	Very low	28.2	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	72%	0.72	S	S	*	*			trans	63.5	149.2	146.8	48.9	0	0	0	0	124
1227	G	24.9	Very low	27.1	Very low	69 Å²	69	138.8 Å²	138.8	71%	0.711	72%	0.723	S	S	*	*			trans	91.4	131.4	167.8	0	0	0	0	0	114.7
1228	W	21.6	Very low	26.9	Very low	233 Å²	233	143.8 Å²	143.8	88%	0.883	73%	0.734	S	S	*	*			cis	63.5	82.4	4.4	-78.9	88.3	0	0	0	117.9
1229	H	26	Very low	26.8	Very low	177 Å²	177	140 Å²	140	82%	0.819	73%	0.728	S	S	*	*				178	141.4	109.6	-106.3	-76.5	0	0	0	114.9
1230	G	26.4	Very low	26.7	Very low	68 Å²	68	137.3 Å²	137.3	70%	0.701	73%	0.725	S	S	*	*			trans	88.2	142.1	147.6	0	0	0	0	0	118.5
1231	Q	25.6	Very low	26.6	Very low	171 Å²	171	139.1 Å²	139.1	80%	0.799	74%	0.736	S	S	*	*			cis	-149.3	143.8	-10.1	-89	-176.4	-83.5	0	0	111.3
1232	M	27	Very low	26.9	Very low	131 Å²	131	139.4 Å²	139.4	65%	0.645	78%	0.777	S	S	*	*			trans	40.9	125.6	135.7	-50.4	171.5	81.1	0	0	118.6
1233	S	27.4	Very low	26.8	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	78%	0.783	S	S	*	*				-154.9	137.6	51	-72.2	0	0	0	0	111.4
1234	R	29.8	Very low	26.8	Very low	224 Å²	224	137.3 Å²	137.3	85%	0.845	79%	0.789	S	S	*	*				55.5	133.9	88.4	-68.7	-178.3	170	-178.7	-3.2	114.1
1235	A	27.4	Very low	26.9	Very low	80 Å²	80	136.4 Å²	136.4	66%	0.661	79%	0.794	S	S	*	*			cis	-146.3	152.9	9.4	0	0	0	0	0	111.5
1236	L	28.1	Very low	27.1	Very low	170 Å²	170	138.9 Å²	138.9	89%	0.89	80%	0.802	S	S	*	*				52.7	139	101.3	-52.3	173.9	0	0	0	115.2
1237	S	25.8	Very low	27.3	Very low	97 Å²	97	140.5 Å²	140.5	68%	0.678	80%	0.802	S	S	*	*			cis	-149.5	144.2	21.2	-164	0	0	0	0	109.2
1238	R	28.9	Very low	27.5	Very low	207 Å²	207	145.3 Å²	145.3	78%	0.781	81%	0.808	S	S	*	*				51.3	128.4	78.8	-116	-169.4	132.3	168.8	-3.8	112.6
1239	D	28.4	Very low	27.9	Very low	117 Å²	117	139 Å²	139	63%	0.626	80%	0.802	S	S	*	*			cis	-163.4	172.5	39.9	-109.8	-53.4	0	0	0	113.8
1240	A	27.1	Very low	28	Very low	78 Å²	78	136.1 Å²	136.1	65%	0.645	80%	0.801	S	S	*	*			trans	60.4	128.4	142.4	0	0	0	0	0	125.2
1241	I	27.3	Very low	28.2	Very low	175 Å²	175	141.8 Å²	141.8	90%	0.897	81%	0.81	S	S	*	*				55.2	116.6	128.6	-53.8	168.3	0	0	0	118.9
1242	G	35.1	Very low	28.4	Very low	148 Å²	148	139.1 Å²	139.1	100%	1.526	81%	0.81	S	S	*	*			trans	178.4	0	170	0	0	0	0	0	111.5

Retrieved 1,242 of 1,242 residues in 1493.5 ms (Link to these results)

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